2-[[3-(4-methoxyphenyl)-2-sulfanylidene-benzimidazol-1-yl]methyl-methyl-amino]-N-propyl-ethanamide

Systemtic Name: 2-[[3-(4-methoxyphenyl)-2-sulfanylidene-benzimidazol-1-yl]methyl-methyl-amino]-N-propyl-ethanamide Openeye Name: 2-[[3-(4-methoxyphenyl)-2-thioxo-benzimidazol-1-yl]methyl-methyl-amino]-N-propyl-acetamide CAS Name: 2-[[3-(4-methoxyphenyl)-2-sulfanylidene-1-benzimidazolyl]methyl-methylamino]-N-propylacetamide IUPAC Name: 2-[[3-(4-methoxyphenyl)-2-sulfanylidenebenzimidazol-1-yl]methyl-methylamino]-N-propylacetamide Traditional Name: 2-[[3-(4-methoxyphenyl)-2-thioxo-benzimidazol-1-yl]methyl-methyl-amino]-N-propyl-acetamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)CN1C2=CC=CC=C2N(C1=S)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCNC(=O)CN(C)CN1C2=CC=CC=C2N(C1=S)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N4O2S/c1-4-13-22-20(26)14-23(2)15-24-18-7-5-6-8-19(18)25(21(24)28)16-9-11-17(27-3)12-10-16/h5-12H,4,13-15H2,1-3H3,(H,22,26)