N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-butyl-5-oxidanylidene-5-thiophen-2-yl-pentanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-butyl-5-oxidanylidene-5-thiophen-2-yl-pentanamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-5-oxo-5-(2-thienyl)pentanamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-butyl-5-oxo-5-thiophen-2-ylpentanamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-butyl-5-oxo-5-thiophen-2-ylpentanamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-5-keto-5-(2-thienyl)valeramide Formula: C24H28N4O4S MolecularWeight: 468.56852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CCCC(=O)C3=CC=CS3

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CCCC(=O)C3=CC=CS3

InChI

InChI=1S/C24H28N4O4S/c1-2-3-14-27(20(30)13-7-11-18(29)19-12-8-15-33-19)21-22(25)28(24(32)26-23(21)31)16-17-9-5-4-6-10-17/h4-6,8-10,12,15H,2-3,7,11,13-14,16,25H2,1H3,(H,26,31,32)