N-(3-methylphenyl)-2-(4-oxidanylidene-3,6-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-methylphenyl)-2-(4-oxidanylidene-3,6-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(m-tolyl)-2-(4-oxo-3,6-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(3-methylphenyl)-2-[(4-oxo-3,6-diphenyl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(3-methylphenyl)-2-(4-oxo-3,6-diphenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(4-keto-3,6-diphenyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(m-tolyl)acetamide Formula: C27H21N3O2S2 MolecularWeight: 483.60454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2C5=CC=CC=C5

InChI

InChI=1S/C27H21N3O2S2/c1-18-9-8-12-20(15-18)28-24(31)17-33-27-29-25-22(16-23(34-25)19-10-4-2-5-11-19)26(32)30(27)21-13-6-3-7-14-21/h2-16H,17H2,1H3,(H,28,31)