nonyl 3-azanyl-6-methyl-5-(phenylcarbamoyl)-4-pyridin-3-yl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: nonyl 3-azanyl-6-methyl-5-(phenylcarbamoyl)-4-pyridin-3-yl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: nonyl 3-amino-6-methyl-5-(phenylcarbamoyl)-4-(3-pyridyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-5-[anilino(oxo)methyl]-6-methyl-4-(3-pyridinyl)-2-thieno[2,3-b]pyridinecarboxylic acid nonyl ester IUPAC Name: nonyl 3-amino-6-methyl-5-(phenylcarbamoyl)-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-6-methyl-5-(phenylcarbamoyl)-4-(3-pyridyl)thieno[2,3-b]pyridine-2-carboxylic acid nonyl ester Formula: C30H34N4O3S MolecularWeight: 530.68096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)C1=C(C2=C(C(=C(N=C2S1)C)C(=O)NC3=CC=CC=C3)C4=CN=CC=C4)N

Isomeric SMILES

CCCCCCCCCOC(=O)C1=C(C2=C(C(=C(N=C2S1)C)C(=O)NC3=CC=CC=C3)C4=CN=CC=C4)N

InChI

InChI=1S/C30H34N4O3S/c1-3-4-5-6-7-8-12-18-37-30(36)27-26(31)25-24(21-14-13-17-32-19-21)23(20(2)33-29(25)38-27)28(35)34-22-15-10-9-11-16-22/h9-11,13-17,19H,3-8,12,18,31H2,1-2H3,(H,34,35)