N-(4-methylphenyl)-2-[(4-oxidanylidene-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-2-phenyl-ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[(4-oxidanylidene-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-2-phenyl-ethanamide Openeye Name: 2-[(4-oxo-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]-2-phenyl-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]-2-phenylacetamide IUPAC Name: N-(4-methylphenyl)-2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-2-phenylacetamide Traditional Name: 2-[(4-keto-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-2-yl)thio]-2-phenyl-N-(p-tolyl)acetamide Formula: C25H23N3O2S2 MolecularWeight: 461.59902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=C(C5=C(S4)CCCC5)C(=O)N3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=C(C5=C(S4)CCCC5)C(=O)N3

InChI

InChI=1S/C25H23N3O2S2/c1-15-11-13-17(14-12-15)26-23(30)21(16-7-3-2-4-8-16)32-25-27-22(29)20-18-9-5-6-10-19(18)31-24(20)28-25/h2-4,7-8,11-14,21H,5-6,9-10H2,1H3,(H,26,30)(H,27,28,29)