methyl 4-chloranyl-3-[5-[(3-methylpyridin-4-yl)carbamoyl]thiophen-2-yl]benzoate

Systemtic Name: methyl 4-chloranyl-3-[5-[(3-methylpyridin-4-yl)carbamoyl]thiophen-2-yl]benzoate Openeye Name: methyl 4-chloro-3-[5-[(3-methyl-4-pyridyl)carbamoyl]-2-thienyl]benzoate CAS Name: 4-chloro-3-[5-[[(3-methyl-4-pyridinyl)amino]-oxomethyl]-2-thiophenyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[5-[(3-methylpyridin-4-yl)carbamoyl]thiophen-2-yl]benzoate Traditional Name: 4-chloro-3-[5-[(3-methyl-4-pyridyl)carbamoyl]-2-thienyl]benzoic acid methyl ester Formula: C19H15ClN2O3S MolecularWeight: 386.852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)NC(=O)C2=CC=C(S2)C3=C(C=CC(=C3)C(=O)OC)Cl

Isomeric SMILES

CC1=C(C=CN=C1)NC(=O)C2=CC=C(S2)C3=C(C=CC(=C3)C(=O)OC)Cl

InChI

InChI=1S/C19H15ClN2O3S/c1-11-10-21-8-7-15(11)22-18(23)17-6-5-16(26-17)13-9-12(19(24)25-2)3-4-14(13)20/h3-10H,1-2H3,(H,21,22,23)