N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-[(2-chlorophenyl)methyl]-N-propyl-pyrazole-4-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-[(2-chlorophenyl)methyl]-N-propyl-pyrazole-4-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-1-[(2-chlorophenyl)methyl]-N-propyl-pyrazole-4-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-1-[(2-chlorophenyl)methyl]-N-propyl-4-pyrazolecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-1-[(2-chlorophenyl)methyl]-N-propylpyrazole-4-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-1-(2-chlorobenzyl)-N-propyl-pyrazole-4-carboxamide Formula: C22H27ClN6O3 MolecularWeight: 458.94118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC)C(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC)C(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl)N

InChI

InChI=1S/C22H27ClN6O3/c1-3-5-11-29-19(24)18(20(30)26-22(29)32)28(10-4-2)21(31)16-12-25-27(14-16)13-15-8-6-7-9-17(15)23/h6-9,12,14H,3-5,10-11,13,24H2,1-2H3,(H,26,30,32)