6-[[2-butyl-1,1,3-tris(oxidanylidene)-5-phenyl-1,2-thiazol-4-yl]amino]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: 6-[[2-butyl-1,1,3-tris(oxidanylidene)-5-phenyl-1,2-thiazol-4-yl]amino]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 6-[(2-butyl-1,1,3-trioxo-5-phenyl-isothiazol-4-yl)amino]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6-[(2-butyl-1,1,3-trioxo-5-phenyl-4-isothiazolyl)amino]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6-[(2-butyl-1,1,3-trioxo-5-phenyl-1,2-thiazol-4-yl)amino]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 6-[(2-butyl-1,1,3-triketo-5-phenyl-isothiazol-4-yl)amino]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C24H28N4O4S MolecularWeight: 468.56852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=CC4=C(CN(CC4)C(=O)NC)C=C3

Isomeric SMILES

CCCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=CC4=C(CN(CC4)C(=O)NC)C=C3

InChI

InChI=1S/C24H28N4O4S/c1-3-4-13-28-23(29)21(22(33(28,31)32)17-8-6-5-7-9-17)26-20-11-10-19-16-27(24(30)25-2)14-12-18(19)15-20/h5-11,15,26H,3-4,12-14,16H2,1-2H3,(H,25,30)