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

Systemtic Name: N-cycloheptyl-2-[(7-methyl-4-oxidanylidene-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-cycloheptyl-2-[(7-methyl-4-oxo-3-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-cycloheptyl-2-[(7-methyl-4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]acetamide IUPAC Name: N-cycloheptyl-2-[(7-methyl-4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-cycloheptyl-2-[(4-keto-7-methyl-3-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C26H31N3O2S2 MolecularWeight: 481.67324

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)NC4CCCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)NC4CCCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C26H31N3O2S2/c1-17-13-14-20-21(15-17)33-24-23(20)25(31)29(19-11-7-4-8-12-19)26(28-24)32-16-22(30)27-18-9-5-2-3-6-10-18/h4,7-8,11-12,17-18H,2-3,5-6,9-10,13-16H2,1H3,(H,27,30)