N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-(3-methylbutyl)-5-oxidanylidene-5-thiophen-2-yl-pentanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-(3-methylbutyl)-5-oxidanylidene-5-thiophen-2-yl-pentanamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-isopentyl-5-oxo-5-(2-thienyl)pentanamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-(3-methylbutyl)-5-oxo-5-thiophen-2-ylpentanamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-(3-methylbutyl)-5-oxo-5-thiophen-2-ylpentanamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-isoamyl-5-keto-5-(2-thienyl)valeramide Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N4O4S/c1-17(2)13-14-28(21(31)12-6-10-19(30)20-11-7-15-34-20)22-23(26)29(25(33)27-24(22)32)16-18-8-4-3-5-9-18/h3-5,7-9,11,15,17H,6,10,12-14,16,26H2,1-2H3,(H,27,32,33)