1-methyl-5-[(4-methyl-2-phenyl-1,3-thiazol-5-yl)methyl-(3-phenylpropyl)amino]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 1-methyl-5-[(4-methyl-2-phenyl-1,3-thiazol-5-yl)methyl-(3-phenylpropyl)amino]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 1-methyl-5-[(4-methyl-2-phenyl-thiazol-5-yl)methyl-(3-phenylpropyl)amino]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 1-methyl-5-[(4-methyl-2-phenyl-5-thiazolyl)methyl-(3-phenylpropyl)amino]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 1-methyl-5-[(4-methyl-2-phenyl-1,3-thiazol-5-yl)methyl-(3-phenylpropyl)amino]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 1-methyl-5-[(4-methyl-2-phenyl-thiazol-5-yl)methyl-(3-phenylpropyl)amino]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C29H32N6OS MolecularWeight: 512.66898

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)N(CCCC3=CC=CC=C3)CC4=C(N=C(S4)C5=CC=CC=C5)C)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)N(CCCC3=CC=CC=C3)CC4=C(N=C(S4)C5=CC=CC=C5)C)C

InChI

InChI=1S/C29H32N6OS/c1-4-12-23-25-26(34(3)33-23)27(36)32-29(31-25)35(18-11-15-21-13-7-5-8-14-21)19-24-20(2)30-28(37-24)22-16-9-6-10-17-22/h5-10,13-14,16-17H,4,11-12,15,18-19H2,1-3H3,(H,31,32,36)