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

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C17H26N6O3S MolecularWeight: 394.49174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CSC2=NC=CN2C

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CSC2=NC=CN2C

InChI

InChI=1S/C17H26N6O3S/c1-4-6-9-22(12(24)11-27-17-19-7-10-21(17)3)13-14(18)23(8-5-2)16(26)20-15(13)25/h7,10H,4-6,8-9,11,18H2,1-3H3,(H,20,25,26)