methyl 2,4-dimethyl-5-[2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-(2-isopropylsulfanylbenzimidazol-1-yl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[2-(propan-2-ylthio)-1-benzimidazolyl]ethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[2-(isopropylthio)benzimidazol-1-yl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2C3=CC=CC=C3N=C2SC(C)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2C3=CC=CC=C3N=C2SC(C)C

InChI

InChI=1S/C20H23N3O3S/c1-11(2)27-20-22-14-8-6-7-9-15(14)23(20)10-16(24)18-12(3)17(13(4)21-18)19(25)26-5/h6-9,11,21H,10H2,1-5H3