6,7-dimethoxy-2-[5-(4-methylpiperazin-1-yl)sulfonyl-3,4-dihydro-1H-isoquinolin-2-yl]-1H-quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-2-[5-(4-methylpiperazin-1-yl)sulfonyl-3,4-dihydro-1H-isoquinolin-2-yl]-1H-quinazolin-4-one Openeye Name: 6,7-dimethoxy-2-[5-(4-methylpiperazin-1-yl)sulfonyl-3,4-dihydro-1H-isoquinolin-2-yl]-1H-quinazolin-4-one CAS Name: 6,7-dimethoxy-2-[5-[(4-methyl-1-piperazinyl)sulfonyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1H-quinazolin-4-one IUPAC Name: 6,7-dimethoxy-2-[5-(4-methylpiperazin-1-yl)sulfonyl-3,4-dihydro-1H-isoquinolin-2-yl]-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[5-(4-methylpiperazino)sulfonyl-3,4-dihydro-1H-isoquinolin-2-yl]-1H-quinazolin-4-one Formula: C24H29N5O5S MolecularWeight: 499.58256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=CC3=C2CCN(C3)C4=NC(=O)C5=CC(=C(C=C5N4)OC)OC

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=CC3=C2CCN(C3)C4=NC(=O)C5=CC(=C(C=C5N4)OC)OC

InChI

InChI=1S/C24H29N5O5S/c1-27-9-11-29(12-10-27)35(31,32)22-6-4-5-16-15-28(8-7-17(16)22)24-25-19-14-21(34-3)20(33-2)13-18(19)23(30)26-24/h4-6,13-14H,7-12,15H2,1-3H3,(H,25,26,30)