methyl 3-[(8-methyl-2-pyridin-3-yl-quinolin-4-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(8-methyl-2-pyridin-3-yl-quinolin-4-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[8-methyl-2-(3-pyridyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[8-methyl-2-(3-pyridinyl)-4-quinolinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(8-methyl-2-pyridin-3-ylquinoline-4-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 3-[[8-methyl-2-(3-pyridyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C22H17N3O3S MolecularWeight: 403.45368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)NC3=C(SC=C3)C(=O)OC)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)NC3=C(SC=C3)C(=O)OC)C4=CN=CC=C4

InChI

InChI=1S/C22H17N3O3S/c1-13-5-3-7-15-16(11-18(24-19(13)15)14-6-4-9-23-12-14)21(26)25-17-8-10-29-20(17)22(27)28-2/h3-12H,1-2H3,(H,25,26)