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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-4-(pyrazol-1-ylmethyl)benzamide Formula: C23H30N6O3 MolecularWeight: 438.5227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC=C(C=C2)CN3C=CC=N3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC=C(C=C2)CN3C=CC=N3)N

InChI

InChI=1S/C23H30N6O3/c1-3-5-14-28(19-20(24)29(15-6-4-2)23(32)26-21(19)30)22(31)18-10-8-17(9-11-18)16-27-13-7-12-25-27/h7-13H,3-6,14-16,24H2,1-2H3,(H,26,30,32)