N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-methyl-benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-methyl-benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-methyl-benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-4-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-methylbenzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-4-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-methylbenzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-methyl-benzamide Formula: C21H25ClN6O3 MolecularWeight: 444.9146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2=CC=C(C=C2)N3C(=C(C(=N3)C)Cl)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2=CC=C(C=C2)N3C(=C(C(=N3)C)Cl)C)N

InChI

InChI=1S/C21H25ClN6O3/c1-5-6-11-27-18(23)17(19(29)24-21(27)31)26(4)20(30)14-7-9-15(10-8-14)28-13(3)16(22)12(2)25-28/h7-10H,5-6,11,23H2,1-4H3,(H,24,29,31)