2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide

Systemtic Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: 2-[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]-N-[oxo-(prop-2-enylamino)methyl]acetamide IUPAC Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[(1-p-phenetylbenzimidazol-2-yl)thio]acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)NC(=O)NCC=C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)NC(=O)NCC=C

InChI

InChI=1S/C21H22N4O3S/c1-3-13-22-20(27)24-19(26)14-29-21-23-17-7-5-6-8-18(17)25(21)15-9-11-16(12-10-15)28-4-2/h3,5-12H,1,4,13-14H2,2H3,(H2,22,24,26,27)