N-(4-butylphenyl)-2-(4-oxidanylidene-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(4-butylphenyl)-2-(4-oxidanylidene-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)ethanamide Openeye Name: N-(4-butylphenyl)-2-(4-oxo-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)acetamide CAS Name: N-(4-butylphenyl)-2-[4-oxo-2-(phenethylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]acetamide IUPAC Name: N-(4-butylphenyl)-2-(4-oxo-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)acetamide Traditional Name: N-(4-butylphenyl)-2-[4-keto-2-(phenethylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]acetamide Formula: C27H31N3O2S MolecularWeight: 461.61894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CN2C(=O)C3=C(CCC3)N=C2SCCC4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CN2C(=O)C3=C(CCC3)N=C2SCCC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2S/c1-2-3-8-21-13-15-22(16-14-21)28-25(31)19-30-26(32)23-11-7-12-24(23)29-27(30)33-18-17-20-9-5-4-6-10-20/h4-6,9-10,13-16H,2-3,7-8,11-12,17-19H2,1H3,(H,28,31)