| Formula |
C21H32N6O2S |
| IUPAC Name |
4-[(1-methyl-3,4-diaza-1-azonia-2-azanidacyclopenta-3,5-dien-5-yl)sulfanyl]-n-[3-[3-(1-piperidylmethyl)phenoxy]propyl]butanamide |
| Molecular Mass |
432.583 g·mol−1 |
| Heat of Formation |
-71.7 ± 16.7 kJ·mol−1 |
| Dipole Moment |
11.02 ± 1.08 D |
| Volume |
541.72 Å 3 |
| Surface Area |
386.05 Å 2 |
| HOMO Energy |
-8.88 ± 0.55 eV |
| LUMO Energy |
-0.62 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 4-(1-methyltetrazol-5-yl)sulfanyl-n-[3-[3-(1-piperidylmethyl)phenoxy]propyl]butanamide
- 4-(1-methyltetrazol-5-yl)sulfanyl-n-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]butanamide
- 4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-n-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]butanamide
- 4-[(1-methyl-5-tetrazolyl)thio]-n-[3-[3-(1-piperidylmethyl)phenoxy]propyl]butanamide
- 4-[(1-methyltetrazol-5-yl)thio]-n-[3-[3-(piperidinomethyl)phenoxy]propyl]butyramide
|
| InChIKey |
WZAQGQDMJJVPIZ-UHFFFAOYSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
S
C
O
N
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