4-(1,3-dimethyl-7-oxidanylidene-6-prop-2-enyl-pyrazolo[4,3-d]pyrimidin-5-yl)-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-(1,3-dimethyl-7-oxidanylidene-6-prop-2-enyl-pyrazolo[4,3-d]pyrimidin-5-yl)-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-(6-allyl-1,3-dimethyl-7-oxo-pyrazolo[4,3-d]pyrimidin-5-yl)-N-phenyl-piperazine-1-carboxamide CAS Name: 4-(1,3-dimethyl-7-oxo-6-prop-2-enyl-5-pyrazolo[4,3-d]pyrimidinyl)-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-(1,3-dimethyl-7-oxo-6-prop-2-enylpyrazolo[4,3-d]pyrimidin-5-yl)-N-phenylpiperazine-1-carboxamide Traditional Name: 4-(6-allyl-7-keto-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-5-yl)-N-phenyl-piperazine-1-carboxamide Formula: C21H25N7O2 MolecularWeight: 407.4689

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(N(C2=O)CC=C)N3CCN(CC3)C(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N(C2=O)CC=C)N3CCN(CC3)C(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C21H25N7O2/c1-4-10-28-19(29)18-17(15(2)24-25(18)3)23-20(28)26-11-13-27(14-12-26)21(30)22-16-8-6-5-7-9-16/h4-9H,1,10-14H2,2-3H3,(H,22,30)