N-(1,2-dihydroacenaphthylen-5-yl)-2-[1-(4-methylphenyl)-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,2-dihydroacenaphthylen-5-yl)-2-[1-(4-methylphenyl)-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,2-dihydroacenaphthylen-5-yl)-2-[6-hydroxy-4-oxo-1-(p-tolyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(1,2-dihydroacenaphthylen-5-yl)-2-[[6-hydroxy-1-(4-methylphenyl)-4-oxo-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(1,2-dihydroacenaphthylen-5-yl)-2-[6-hydroxy-1-(4-methylphenyl)-4-oxopyrimidin-2-yl]sulfanylacetamide Traditional Name: N-acenaphthen-5-yl-2-[[6-hydroxy-4-keto-1-(p-tolyl)pyrimidin-2-yl]thio]acetamide Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=O)N=C2SCC(=O)NC3=C4C=CC=C5C4=C(CC5)C=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=O)N=C2SCC(=O)NC3=C4C=CC=C5C4=C(CC5)C=C3)O

InChI

InChI=1S/C25H21N3O3S/c1-15-5-10-18(11-6-15)28-23(31)13-21(29)27-25(28)32-14-22(30)26-20-12-9-17-8-7-16-3-2-4-19(20)24(16)17/h2-6,9-13,31H,7-8,14H2,1H3,(H,26,30)