ethyl 6-[[(4-methylphenyl)-thiophen-2-yl-methyl]amino]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[[(4-methylphenyl)-thiophen-2-yl-methyl]amino]pyridine-3-carboxylate Openeye Name: ethyl 6-[[p-tolyl(2-thienyl)methyl]amino]pyridine-3-carboxylate CAS Name: 6-[[(4-methylphenyl)-thiophen-2-ylmethyl]amino]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[[(4-methylphenyl)-thiophen-2-ylmethyl]amino]pyridine-3-carboxylate Traditional Name: 6-[[p-tolyl(2-thienyl)methyl]amino]nicotinic acid ethyl ester Formula: C20H20N2O2S MolecularWeight: 352.45

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)NC(C2=CC=C(C=C2)C)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)NC(C2=CC=C(C=C2)C)C3=CC=CS3

InChI

InChI=1S/C20H20N2O2S/c1-3-24-20(23)16-10-11-18(21-13-16)22-19(17-5-4-12-25-17)15-8-6-14(2)7-9-15/h4-13,19H,3H2,1-2H3,(H,21,22)