N-(4-bromophenyl)-2-[6-methyl-4-oxidanylidene-3-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[6-methyl-4-oxidanylidene-3-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-[6-methyl-4-oxo-3-(3-pyridylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(4-bromophenyl)-2-[[6-methyl-4-oxo-3-(3-pyridinylmethyl)-2-thieno[2,3-d]pyrimidinyl]thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[6-methyl-4-oxo-3-(pyridin-3-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(4-bromophenyl)-2-[[4-keto-6-methyl-3-(3-pyridylmethyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetamide Formula: C21H17BrN4O2S2 MolecularWeight: 501.41928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)N=C(N(C2=O)CC3=CN=CC=C3)SCC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC2=C(S1)N=C(N(C2=O)CC3=CN=CC=C3)SCC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H17BrN4O2S2/c1-13-9-17-19(30-13)25-21(26(20(17)28)11-14-3-2-8-23-10-14)29-12-18(27)24-16-6-4-15(22)5-7-16/h2-10H,11-12H2,1H3,(H,24,27)