2-[[3-(4-bromophenyl)-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(4-phenylphenyl)methylideneamino]ethanamide

Systemtic Name: 2-[[3-(4-bromophenyl)-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(4-phenylphenyl)methylideneamino]ethanamide Openeye Name: 2-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(4-phenylphenyl)methyleneamino]acetamide CAS Name: 2-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]thio]-N-[(4-phenylphenyl)methylideneamino]acetamide IUPAC Name: 2-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(4-phenylphenyl)methylideneamino]acetamide Traditional Name: 2-[[3-(4-bromophenyl)-4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]thio]-N-[(4-phenylbenzylidene)amino]acetamide Formula: C31H25BrN4O2S2 MolecularWeight: 629.5898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=C(C=C4)Br)SCC(=O)NN=CC5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=C(C=C4)Br)SCC(=O)NN=CC5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H25BrN4O2S2/c32-23-14-16-24(17-15-23)36-30(38)28-25-8-4-5-9-26(25)40-29(28)34-31(36)39-19-27(37)35-33-18-20-10-12-22(13-11-20)21-6-2-1-3-7-21/h1-3,6-7,10-18H,4-5,8-9,19H2,(H,35,37)