N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-2-(1H-benzimidazol-2-ylsulfanyl)-N-butyl-ethanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-2-(1H-benzimidazol-2-ylsulfanyl)-N-butyl-ethanamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-2-(1H-benzimidazol-2-ylsulfanyl)-N-butyl-acetamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-2-(1H-benzimidazol-2-ylthio)-N-butylacetamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-2-(1H-benzimidazol-2-ylsulfanyl)-N-butylacetamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-2-(1H-benzimidazol-2-ylthio)-N-butyl-acetamide Formula: C24H26N6O3S MolecularWeight: 478.56664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C24H26N6O3S/c1-2-3-13-29(19(31)15-34-23-26-17-11-7-8-12-18(17)27-23)20-21(25)30(24(33)28-22(20)32)14-16-9-5-4-6-10-16/h4-12H,2-3,13-15,25H2,1H3,(H,26,27)(H,28,32,33)