methyl 2-benzamido-3-[[6-[2,5-bis(chloranyl)phenyl]sulfanylpyridin-3-yl]amino]prop-2-enoate

Systemtic Name: methyl 2-benzamido-3-[[6-[2,5-bis(chloranyl)phenyl]sulfanylpyridin-3-yl]amino]prop-2-enoate Openeye Name: methyl 2-benzamido-3-[[6-(2,5-dichlorophenyl)sulfanyl-3-pyridyl]amino]prop-2-enoate CAS Name: 2-benzamido-3-[[6-[(2,5-dichlorophenyl)thio]-3-pyridinyl]amino]-2-propenoic acid methyl ester IUPAC Name: methyl 2-benzamido-3-[[6-(2,5-dichlorophenyl)sulfanylpyridin-3-yl]amino]prop-2-enoate Traditional Name: 2-benzamido-3-[[6-[(2,5-dichlorophenyl)thio]-3-pyridyl]amino]acrylic acid methyl ester Formula: C22H17Cl2N3O3S MolecularWeight: 474.35968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17Cl2N3O3S/c1-30-22(29)18(27-21(28)14-5-3-2-4-6-14)13-25-16-8-10-20(26-12-16)31-19-11-15(23)7-9-17(19)24/h2-13,25H,1H3,(H,27,28)