1-methyl-5-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 1-methyl-5-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 1-methyl-5-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 1-methyl-5-[[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 1-methyl-5-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 1-methyl-5-[4-(4-methylpiperazino)sulfonylbenzyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C21H28N6O3S MolecularWeight: 444.55042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)CC3=CC=C(C=C3)S(=O)(=O)N4CCN(CC4)C)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)CC3=CC=C(C=C3)S(=O)(=O)N4CCN(CC4)C)C

InChI

InChI=1S/C21H28N6O3S/c1-4-5-17-19-20(26(3)24-17)21(28)23-18(22-19)14-15-6-8-16(9-7-15)31(29,30)27-12-10-25(2)11-13-27/h6-9H,4-5,10-14H2,1-3H3,(H,22,23,28)