N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(6-amino-1-isobutyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-2-(1-methylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-N-butyl-2-[(1-methyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-butyl-2-(1-methylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(6-amino-1-isobutyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-2-[(1-methylbenzimidazol-2-yl)thio]acetamide Formula: C22H30N6O3S MolecularWeight: 458.577

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CC(C)C)N)C(=O)CSC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CC(C)C)N)C(=O)CSC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C22H30N6O3S/c1-5-6-11-27(18-19(23)28(12-14(2)3)21(31)25-20(18)30)17(29)13-32-22-24-15-9-7-8-10-16(15)26(22)4/h7-10,14H,5-6,11-13,23H2,1-4H3,(H,25,30,31)