4-[(diphenylmethyl)amino]-2-(4-methylsulfonylpiperazin-1-yl)-6-propan-2-yl-5H-pyrrolo[3,4-d]pyrimidin-7-one

Systemtic Name: 4-[(diphenylmethyl)amino]-2-(4-methylsulfonylpiperazin-1-yl)-6-propan-2-yl-5H-pyrrolo[3,4-d]pyrimidin-7-one Openeye Name: 4-(benzhydrylamino)-6-isopropyl-2-(4-methylsulfonylpiperazin-1-yl)-5H-pyrrolo[3,4-d]pyrimidin-7-one CAS Name: 4-[(diphenylmethyl)amino]-2-(4-methylsulfonyl-1-piperazinyl)-6-propan-2-yl-5H-pyrrolo[3,4-d]pyrimidin-7-one IUPAC Name: 4-(benzhydrylamino)-2-(4-methylsulfonylpiperazin-1-yl)-6-propan-2-yl-5H-pyrrolo[3,4-d]pyrimidin-7-one Traditional Name: 4-(benzhydrylamino)-6-isopropyl-2-(4-mesylpiperazino)-5H-pyrrolo[3,4-d]pyrimidin-7-one Formula: C27H32N6O3S MolecularWeight: 520.64638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC2=C(C1=O)N=C(N=C2NC(C3=CC=CC=C3)C4=CC=CC=C4)N5CCN(CC5)S(=O)(=O)C

Isomeric SMILES

CC(C)N1CC2=C(C1=O)N=C(N=C2NC(C3=CC=CC=C3)C4=CC=CC=C4)N5CCN(CC5)S(=O)(=O)C

InChI

InChI=1S/C27H32N6O3S/c1-19(2)33-18-22-24(26(33)34)29-27(31-14-16-32(17-15-31)37(3,35)36)30-25(22)28-23(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-13,19,23H,14-18H2,1-3H3,(H,28,29,30)