ethyl 4-(3,4-dimethoxyphenyl)-2-[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C25H25N3O5S2 MolecularWeight: 511.6131

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)CSC3=NC4=C(N3)C=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)CSC3=NC4=C(N3)C=C(C=C4)C

InChI

InChI=1S/C25H25N3O5S2/c1-5-33-24(30)22-16(15-7-9-19(31-3)20(11-15)32-4)12-34-23(22)28-21(29)13-35-25-26-17-8-6-14(2)10-18(17)27-25/h6-12H,5,13H2,1-4H3,(H,26,27)(H,28,29)