3-bromanyl-N-[2-[(3-methylphenyl)methylsulfanyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]benzamide

Systemtic Name: 3-bromanyl-N-[2-[(3-methylphenyl)methylsulfanyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]benzamide Openeye Name: 3-bromo-N-[2-(m-tolylmethylsulfanyl)-4-oxo-thieno[3,2-d]pyrimidin-3-yl]benzamide CAS Name: 3-bromo-N-[2-[(3-methylphenyl)methylthio]-4-oxo-3-thieno[3,2-d]pyrimidinyl]benzamide IUPAC Name: 3-bromo-N-[2-[(3-methylphenyl)methylsulfanyl]-4-oxothieno[3,2-d]pyrimidin-3-yl]benzamide Traditional Name: 3-bromo-N-[4-keto-2-[(3-methylbenzyl)thio]thieno[3,2-d]pyrimidin-3-yl]benzamide Formula: C21H16BrN3O2S2 MolecularWeight: 486.40464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NC3=C(C(=O)N2NC(=O)C4=CC(=CC=C4)Br)SC=C3

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NC3=C(C(=O)N2NC(=O)C4=CC(=CC=C4)Br)SC=C3

InChI

InChI=1S/C21H16BrN3O2S2/c1-13-4-2-5-14(10-13)12-29-21-23-17-8-9-28-18(17)20(27)25(21)24-19(26)15-6-3-7-16(22)11-15/h2-11H,12H2,1H3,(H,24,26)