3-(methylsulfanylmethyl)-N-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)benzamide

Systemtic Name: 3-(methylsulfanylmethyl)-N-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)benzamide Openeye Name: 3-(methylsulfanylmethyl)-N-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)benzamide CAS Name: 3-[(methylthio)methyl]-N-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)benzamide IUPAC Name: 3-(methylsulfanylmethyl)-N-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)benzamide Traditional Name: N-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-3-[(methylthio)methyl]benzamide Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=CC(=C1)C(=O)NN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4

Isomeric SMILES

CSCC1=CC=CC(=C1)C(=O)NN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2S2/c1-27-11-14-6-5-9-16(10-14)19(25)23-24-13-22-20-18(21(24)26)17(12-28-20)15-7-3-2-4-8-15/h2-10,12-13H,11H2,1H3,(H,23,25)