N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(1-methylbenzimidazol-2-yl)sulfanyl-N-(3-methylbutyl)ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(1-methylbenzimidazol-2-yl)sulfanyl-N-(3-methylbutyl)ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-isopentyl-2-(1-methylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-[(1-methyl-2-benzimidazolyl)thio]-N-(3-methylbutyl)acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-N-(3-methylbutyl)acetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-isoamyl-2-[(1-methylbenzimidazol-2-yl)thio]acetamide Formula: C23H32N6O3S MolecularWeight: 472.60358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)CSC2=NC3=CC=CC=C3N2C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)CSC2=NC3=CC=CC=C3N2C)N

InChI

InChI=1S/C23H32N6O3S/c1-5-6-12-29-20(24)19(21(31)26-22(29)32)28(13-11-15(2)3)18(30)14-33-23-25-16-9-7-8-10-17(16)27(23)4/h7-10,15H,5-6,11-14,24H2,1-4H3,(H,26,31,32)