3-[4-(diethylamino)-2-methyl-phenyl]imino-6-heptyl-5-(2-methylbutan-2-yl)-2-propan-2-yl-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 3-[4-(diethylamino)-2-methyl-phenyl]imino-6-heptyl-5-(2-methylbutan-2-yl)-2-propan-2-yl-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 3-[4-(diethylamino)-2-methyl-phenyl]imino-5-(1,1-dimethylpropyl)-6-heptyl-2-isopropyl-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 3-[4-(diethylamino)-2-methylphenyl]imino-6-heptyl-5-(2-methylbutan-2-yl)-2-propan-2-yl-7-pyrazolo[1,5-a]pyrimidinone IUPAC Name: 3-[4-(diethylamino)-2-methylphenyl]imino-6-heptyl-5-(2-methylbutan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 5-tert-amyl-3-[4-(diethylamino)-2-methyl-phenyl]imino-6-heptyl-2-isopropyl-pyrazolo[1,5-a]pyrimidin-7-one Formula: C32H49N5O MolecularWeight: 519.76436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(N=C2C(=NC3=C(C=C(C=C3)N(CC)CC)C)C(=NN2C1=O)C(C)C)C(C)(C)CC

Isomeric SMILES

CCCCCCCC1=C(N=C2C(=NC3=C(C=C(C=C3)N(CC)CC)C)C(=NN2C1=O)C(C)C)C(C)(C)CC

InChI

InChI=1S/C32H49N5O/c1-10-14-15-16-17-18-25-29(32(8,9)11-2)34-30-28(27(22(5)6)35-37(30)31(25)38)33-26-20-19-24(21-23(26)7)36(12-3)13-4/h19-22H,10-18H2,1-9H3