N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-5-methyl-N-(3-methylbutyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-5-methyl-N-(3-methylbutyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-isopentyl-5-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-5-methyl-N-(3-methylbutyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-5-methyl-N-(3-methylbutyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-isoamyl-5-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C27H30N6O3 MolecularWeight: 486.5655

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N(CCC(C)C)C3=C(N(C(=O)NC3=O)CC4=CC=CC=C4)N

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N(CCC(C)C)C3=C(N(C(=O)NC3=O)CC4=CC=CC=C4)N

InChI

InChI=1S/C27H30N6O3/c1-18(2)14-15-31(26(35)22-16-29-33(19(22)3)21-12-8-5-9-13-21)23-24(28)32(27(36)30-25(23)34)17-20-10-6-4-7-11-20/h4-13,16,18H,14-15,17,28H2,1-3H3,(H,30,34,36)