methyl (Z)-2-[2-(3-chlorophenyl)carbonylpyrrol-1-yl]-3-methylsulfanyl-prop-2-enoate

Systemtic Name: methyl (Z)-2-[2-(3-chlorophenyl)carbonylpyrrol-1-yl]-3-methylsulfanyl-prop-2-enoate Openeye Name: methyl (Z)-2-[2-(3-chlorobenzoyl)pyrrol-1-yl]-3-methylsulfanyl-prop-2-enoate CAS Name: (Z)-2-[2-[(3-chlorophenyl)-oxomethyl]-1-pyrrolyl]-3-(methylthio)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-[2-(3-chlorobenzoyl)pyrrol-1-yl]-3-methylsulfanylprop-2-enoate Traditional Name: (Z)-2-[2-(3-chlorobenzoyl)pyrrol-1-yl]-3-(methylthio)acrylic acid methyl ester Formula: C16H14ClNO3S MolecularWeight: 335.80526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CSC)N1C=CC=C1C(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

COC(=O)/C(=C/SC)/N1C=CC=C1C(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H14ClNO3S/c1-21-16(20)14(10-22-2)18-8-4-7-13(18)15(19)11-5-3-6-12(17)9-11/h3-10H,1-2H3/b14-10-