N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-(1-benzylimidazol-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]acetamide CAS Name: N-[[2-(1-cyclohexenyl)ethylamino]-oxomethyl]-2-[[1-(phenylmethyl)-2-imidazolyl]thio]acetamide IUPAC Name: 2-(1-benzylimidazol-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]acetamide Traditional Name: 2-[(1-benzylimidazol-2-yl)thio]-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]acetamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)NC(=O)CSC2=NC=CN2CC3=CC=CC=C3

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)NC(=O)CSC2=NC=CN2CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O2S/c26-19(24-20(27)22-12-11-17-7-3-1-4-8-17)16-28-21-23-13-14-25(21)15-18-9-5-2-6-10-18/h2,5-7,9-10,13-14H,1,3-4,8,11-12,15-16H2,(H2,22,24,26,27)