7-[4-(aminomethyl)phenyl]-9-cyclopropyl-8-methoxy-[1,2]thiazolo[5,4-b]quinoline-3,4-dione

Systemtic Name: 7-[4-(aminomethyl)phenyl]-9-cyclopropyl-8-methoxy-[1,2]thiazolo[5,4-b]quinoline-3,4-dione Openeye Name: 7-[4-(aminomethyl)phenyl]-9-cyclopropyl-8-methoxy-isothiazolo[5,4-b]quinoline-3,4-dione CAS Name: 7-[4-(aminomethyl)phenyl]-9-cyclopropyl-8-methoxyisothiazolo[5,4-b]quinoline-3,4-dione IUPAC Name: 7-[4-(aminomethyl)phenyl]-9-cyclopropyl-8-methoxy-[1,2]thiazolo[5,4-b]quinoline-3,4-dione Traditional Name: 7-[4-(aminomethyl)phenyl]-9-cyclopropyl-8-methoxy-isothiazolo[5,4-b]quinoline-3,4-quinone Formula: C21H19N3O3S MolecularWeight: 393.45886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1N(C3=C(C2=O)C(=O)NS3)C4CC4)C5=CC=C(C=C5)CN

Isomeric SMILES

COC1=C(C=CC2=C1N(C3=C(C2=O)C(=O)NS3)C4CC4)C5=CC=C(C=C5)CN

InChI

InChI=1S/C21H19N3O3S/c1-27-19-14(12-4-2-11(10-22)3-5-12)8-9-15-17(19)24(13-6-7-13)21-16(18(15)25)20(26)23-28-21/h2-5,8-9,13H,6-7,10,22H2,1H3,(H,23,26)