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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-ethyl-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-ethyl-2-[1-(o-tolyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-ethyl-2-[[1-(2-methylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-ethyl-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-ethyl-2-[[1-(o-tolyl)imidazol-2-yl]thio]acetamide Formula: C22H28N6O3S MolecularWeight: 456.56112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)CSC2=NC=CN2C3=CC=CC=C3C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)CSC2=NC=CN2C3=CC=CC=C3C)N

InChI

InChI=1S/C22H28N6O3S/c1-4-6-12-28-19(23)18(20(30)25-21(28)31)26(5-2)17(29)14-32-22-24-11-13-27(22)16-10-8-7-9-15(16)3/h7-11,13H,4-6,12,14,23H2,1-3H3,(H,25,30,31)