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

Systemtic Name: 1-methyl-5-[2-methyl-5-(4-methylpiperazin-1-yl)sulfonyl-thiophen-3-yl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 1-methyl-5-[2-methyl-5-(4-methylpiperazin-1-yl)sulfonyl-3-thienyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 1-methyl-5-[2-methyl-5-[(4-methyl-1-piperazinyl)sulfonyl]-3-thiophenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 1-methyl-5-[2-methyl-5-(4-methylpiperazin-1-yl)sulfonylthiophen-3-yl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 1-methyl-5-[2-methyl-5-(4-methylpiperazino)sulfonyl-3-thienyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C19H26N6O3S2 MolecularWeight: 450.57814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N6O3S2/c1-5-6-14-16-17(24(4)22-14)19(26)21-18(20-16)13-11-15(29-12(13)2)30(27,28)25-9-7-23(3)8-10-25/h11H,5-10H2,1-4H3,(H,20,21,26)