methyl 2-benzamido-3-[[6-(4-chlorophenyl)sulfanylpyridin-3-yl]amino]prop-2-enoate

Systemtic Name: methyl 2-benzamido-3-[[6-(4-chlorophenyl)sulfanylpyridin-3-yl]amino]prop-2-enoate Openeye Name: methyl 2-benzamido-3-[[6-(4-chlorophenyl)sulfanyl-3-pyridyl]amino]prop-2-enoate CAS Name: 2-benzamido-3-[[6-[(4-chlorophenyl)thio]-3-pyridinyl]amino]-2-propenoic acid methyl ester IUPAC Name: methyl 2-benzamido-3-[[6-(4-chlorophenyl)sulfanylpyridin-3-yl]amino]prop-2-enoate Traditional Name: 2-benzamido-3-[[6-[(4-chlorophenyl)thio]-3-pyridyl]amino]acrylic acid methyl ester Formula: C22H18ClN3O3S MolecularWeight: 439.91462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CNC1=CN=C(C=C1)SC2=CC=C(C=C2)Cl)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C(=CNC1=CN=C(C=C1)SC2=CC=C(C=C2)Cl)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H18ClN3O3S/c1-29-22(28)19(26-21(27)15-5-3-2-4-6-15)14-24-17-9-12-20(25-13-17)30-18-10-7-16(23)8-11-18/h2-14,24H,1H3,(H,26,27)