2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-oxidanylideneazepan-3-yl)ethanamide

Systemtic Name: 2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-oxidanylideneazepan-3-yl)ethanamide Openeye Name: 2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-oxoazepan-3-yl)acetamide CAS Name: 2-[[1-(3-methoxyphenyl)-2-imidazolyl]thio]-N-(2-oxo-3-azepanyl)acetamide IUPAC Name: 2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-oxoazepan-3-yl)acetamide Traditional Name: N-(2-ketoazepan-3-yl)-2-[[1-(3-methoxyphenyl)imidazol-2-yl]thio]acetamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)NC3CCCCNC3=O

Isomeric SMILES

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)NC3CCCCNC3=O

InChI

InChI=1S/C18H22N4O3S/c1-25-14-6-4-5-13(11-14)22-10-9-20-18(22)26-12-16(23)21-15-7-2-3-8-19-17(15)24/h4-6,9-11,15H,2-3,7-8,12H2,1H3,(H,19,24)(H,21,23)