N-(4-methoxyphenyl)-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-(4-methoxyphenyl)-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-(4-methoxyphenyl)-2-[(7-methyl-4-oxo-3-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(4-methoxyphenyl)-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-(4-methoxyphenyl)-2-[(7-methyl-4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(4-keto-7-methyl-3-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)thio]-N-(4-methoxyphenyl)acetamide Formula: C26H25N3O3S2 MolecularWeight: 491.625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC=C(C=C4)OC)C5=CC=CC=C5

Isomeric SMILES

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC=C(C=C4)OC)C5=CC=CC=C5

InChI

InChI=1S/C26H25N3O3S2/c1-16-8-13-20-21(14-16)34-24-23(20)25(31)29(18-6-4-3-5-7-18)26(28-24)33-15-22(30)27-17-9-11-19(32-2)12-10-17/h3-7,9-12,16H,8,13-15H2,1-2H3,(H,27,30)