7-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-6-(thiophen-2-ylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one

Systemtic Name: 7-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-6-(thiophen-2-ylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one Openeye Name: 7-(4-chloro-2-methoxy-5-methyl-anilino)-6-(2-thienylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one CAS Name: 7-(4-chloro-2-methoxy-5-methylanilino)-6-(thiophen-2-ylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one IUPAC Name: 7-(4-chloro-2-methoxy-5-methylanilino)-6-(thiophen-2-ylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one Traditional Name: 7-(4-chloro-2-methoxy-5-methyl-anilino)-6-(2-thenyl)-7H-pyrrolo[3,4-b]pyridin-5-one Formula: C20H18ClN3O2S MolecularWeight: 399.89382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC2C3=C(C=CC=N3)C(=O)N2CC4=CC=CS4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC2C3=C(C=CC=N3)C(=O)N2CC4=CC=CS4

InChI

InChI=1S/C20H18ClN3O2S/c1-12-9-16(17(26-2)10-15(12)21)23-19-18-14(6-3-7-22-18)20(25)24(19)11-13-5-4-8-27-13/h3-10,19,23H,11H2,1-2H3