3-azanyl-2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-azanyl-2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-amino-2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-amino-2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-amino-2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-amino-2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H14BrN3O2S2 MolecularWeight: 472.37806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(N(C3=O)N)SCC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(N(C3=O)N)SCC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H14BrN3O2S2/c21-14-8-6-12(7-9-14)16(25)11-27-20-23-18-15(19(26)24(20)22)10-17(28-18)13-4-2-1-3-5-13/h1-10H,11,22H2