methyl 2,4-dimethyl-5-[(2R)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[(2R)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[(2R)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[(2R)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]-1-oxopropyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[(2R)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[(2R)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]propanoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SC(C)C(=O)C3=C(C(=C(N3)C)C(=O)OC)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)S[C@H](C)C(=O)C3=C(C(=C(N3)C)C(=O)OC)C

InChI

InChI=1S/C19H21N3O3S/c1-9-6-7-13-14(8-9)22-19(21-13)26-12(4)17(23)16-10(2)15(11(3)20-16)18(24)25-5/h6-8,12,20H,1-5H3,(H,21,22)/t12-/m1/s1