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

Systemtic Name: N-(4-methylphenyl)-2-[(2-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]ethanamide Openeye Name: 2-[(2-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[(2-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)thio]acetamide IUPAC Name: N-(4-methylphenyl)-2-[(2-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide Traditional Name: 2-[(2-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)thio]-N-(p-tolyl)acetamide Formula: C25H23N3OS2 MolecularWeight: 445.59962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=C2C4=C(S3)CCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=C2C4=C(S3)CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C25H23N3OS2/c1-16-11-13-18(14-12-16)26-21(29)15-30-24-22-19-9-5-6-10-20(19)31-25(22)28-23(27-24)17-7-3-2-4-8-17/h2-4,7-8,11-14H,5-6,9-10,15H2,1H3,(H,26,29)