N-(4-iodanyl-2-methyl-phenyl)-2-[4-oxidanylidene-2-(phenylmethylsulfanyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]ethanamide

Systemtic Name: N-(4-iodanyl-2-methyl-phenyl)-2-[4-oxidanylidene-2-(phenylmethylsulfanyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]ethanamide Openeye Name: 2-(2-benzylsulfanyl-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)-N-(4-iodo-2-methyl-phenyl)acetamide CAS Name: N-(4-iodo-2-methylphenyl)-2-[4-oxo-2-(phenylmethylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]acetamide IUPAC Name: 2-(2-benzylsulfanyl-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)-N-(4-iodo-2-methylphenyl)acetamide Traditional Name: 2-[2-(benzylthio)-4-keto-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]-N-(4-iodo-2-methyl-phenyl)acetamide Formula: C23H22IN3O2S MolecularWeight: 531.40915

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)CN2C(=O)C3=C(CCC3)N=C2SCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)CN2C(=O)C3=C(CCC3)N=C2SCC4=CC=CC=C4

InChI

InChI=1S/C23H22IN3O2S/c1-15-12-17(24)10-11-19(15)25-21(28)13-27-22(29)18-8-5-9-20(18)26-23(27)30-14-16-6-3-2-4-7-16/h2-4,6-7,10-12H,5,8-9,13-14H2,1H3,(H,25,28)