3-(aminomethyl)-2-(2-methylpropyl)-6-(4-methyl-1,3-thiazol-2-yl)-4-phenyl-isoquinolin-1-one

Systemtic Name: 3-(aminomethyl)-2-(2-methylpropyl)-6-(4-methyl-1,3-thiazol-2-yl)-4-phenyl-isoquinolin-1-one Openeye Name: 3-(aminomethyl)-2-isobutyl-6-(4-methylthiazol-2-yl)-4-phenyl-isoquinolin-1-one CAS Name: 3-(aminomethyl)-2-(2-methylpropyl)-6-(4-methyl-2-thiazolyl)-4-phenyl-1-isoquinolinone IUPAC Name: 3-(aminomethyl)-2-(2-methylpropyl)-6-(4-methyl-1,3-thiazol-2-yl)-4-phenylisoquinolin-1-one Traditional Name: 3-(aminomethyl)-2-isobutyl-6-(4-methylthiazol-2-yl)-4-phenyl-isocarbostyril Formula: C24H25N3OS MolecularWeight: 403.5398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C2=CC3=C(C=C2)C(=O)N(C(=C3C4=CC=CC=C4)CN)CC(C)C

Isomeric SMILES

CC1=CSC(=N1)C2=CC3=C(C=C2)C(=O)N(C(=C3C4=CC=CC=C4)CN)CC(C)C

InChI

InChI=1S/C24H25N3OS/c1-15(2)13-27-21(12-25)22(17-7-5-4-6-8-17)20-11-18(9-10-19(20)24(27)28)23-26-16(3)14-29-23/h4-11,14-15H,12-13,25H2,1-3H3