N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(4-methoxyphenyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(4-methoxyphenyl)-1,3-thiazole-4-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(4-methoxyphenyl)thiazole-4-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(4-methoxyphenyl)-4-thiazolecarboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-(4-methoxyphenyl)-1,3-thiazole-4-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(4-methoxyphenyl)thiazole-4-carboxamide Formula: C22H22N4O2S2 MolecularWeight: 438.56568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H22N4O2S2/c1-28-15-9-7-14(8-10-15)22-26-19(13-30-22)21(27)25-18(11-12-29-2)20-23-16-5-3-4-6-17(16)24-20/h3-10,13,18H,11-12H2,1-2H3,(H,23,24)(H,25,27)