2-(4-aminophenyl)-5-[5-(4-methylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 2-(4-aminophenyl)-5-[5-(4-methylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 2-(4-aminophenyl)-5-[5-(4-methylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 2-(4-aminophenyl)-5-[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 2-(4-aminophenyl)-5-[5-(4-methylpiperazin-1-yl)sulfonyl-2-propoxyphenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 2-(4-aminophenyl)-5-[5-(4-methylpiperazino)sulfonyl-2-propoxy-phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C28H35N7O4S MolecularWeight: 565.687

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=NN1C3=CC=C(C=C3)N)C(=O)N=C(N2)C4=C(C=CC(=C4)S(=O)(=O)N5CCN(CC5)C)OCCC

Isomeric SMILES

CCCC1=C2C(=NN1C3=CC=C(C=C3)N)C(=O)N=C(N2)C4=C(C=CC(=C4)S(=O)(=O)N5CCN(CC5)C)OCCC

InChI

InChI=1S/C28H35N7O4S/c1-4-6-23-25-26(32-35(23)20-9-7-19(29)8-10-20)28(36)31-27(30-25)22-18-21(11-12-24(22)39-17-5-2)40(37,38)34-15-13-33(3)14-16-34/h7-12,18H,4-6,13-17,29H2,1-3H3,(H,30,31,36)