methyl 4-[[3-(thiophen-2-ylmethylcarbamoyl)pyridin-2-yl]amino]benzoate

Systemtic Name: methyl 4-[[3-(thiophen-2-ylmethylcarbamoyl)pyridin-2-yl]amino]benzoate Openeye Name: methyl 4-[[3-(2-thienylmethylcarbamoyl)-2-pyridyl]amino]benzoate CAS Name: 4-[[3-[oxo-(thiophen-2-ylmethylamino)methyl]-2-pyridinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(thiophen-2-ylmethylcarbamoyl)pyridin-2-yl]amino]benzoate Traditional Name: 4-[[3-(2-thenylcarbamoyl)-2-pyridyl]amino]benzoic acid methyl ester Formula: C19H17N3O3S MolecularWeight: 367.42158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)NCC3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)NCC3=CC=CS3

InChI

InChI=1S/C19H17N3O3S/c1-25-19(24)13-6-8-14(9-7-13)22-17-16(5-2-10-20-17)18(23)21-12-15-4-3-11-26-15/h2-11H,12H2,1H3,(H,20,22)(H,21,23)