methyl 5-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[[1-(3-chlorophenyl)-2-imidazolyl]thio]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[[1-(3-chlorophenyl)imidazol-2-yl]thio]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C19H18ClN3O3S MolecularWeight: 403.88252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)CSC2=NC=CN2C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)CSC2=NC=CN2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H18ClN3O3S/c1-11-16(18(25)26-3)12(2)22-17(11)15(24)10-27-19-21-7-8-23(19)14-6-4-5-13(20)9-14/h4-9,22H,10H2,1-3H3