2-[3-(4-bromophenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-N-(3-methoxyphenyl)ethanamide

Systemtic Name: 2-[3-(4-bromophenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[3-(4-bromophenyl)-4-oxo-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-N-(3-methoxyphenyl)acetamide CAS Name: 2-[[3-(4-bromophenyl)-4-oxo-2-thieno[3,2-d]pyrimidinyl]thio]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-[3-(4-bromophenyl)-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanyl-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[[3-(4-bromophenyl)-4-keto-thieno[3,2-d]pyrimidin-2-yl]thio]-N-(3-methoxyphenyl)acetamide Formula: C21H16BrN3O3S2 MolecularWeight: 502.40404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)Br)SC=C3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)Br)SC=C3

InChI

InChI=1S/C21H16BrN3O3S2/c1-28-16-4-2-3-14(11-16)23-18(26)12-30-21-24-17-9-10-29-19(17)20(27)25(21)15-7-5-13(22)6-8-15/h2-11H,12H2,1H3,(H,23,26)