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

Systemtic Name: N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-5-oxidanylidene-5-thiophen-2-yl-pentanamide Openeye Name: N-(6-amino-1-isobutyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-5-oxo-5-(2-thienyl)pentanamide CAS Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-N-butyl-5-oxo-5-thiophen-2-ylpentanamide IUPAC Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-butyl-5-oxo-5-thiophen-2-ylpentanamide Traditional Name: N-(6-amino-1-isobutyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-5-keto-5-(2-thienyl)valeramide Formula: C21H30N4O4S MolecularWeight: 434.5523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CC(C)C)N)C(=O)CCCC(=O)C2=CC=CS2

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CC(C)C)N)C(=O)CCCC(=O)C2=CC=CS2

InChI

InChI=1S/C21H30N4O4S/c1-4-5-11-24(17(27)10-6-8-15(26)16-9-7-12-30-16)18-19(22)25(13-14(2)3)21(29)23-20(18)28/h7,9,12,14H,4-6,8,10-11,13,22H2,1-3H3,(H,23,28,29)