N-[[4-(3-bromanyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]carbamothioyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[[4-(3-bromanyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]carbamothioyl]-2,2-diphenyl-ethanamide Openeye Name: N-[[4-(3-bromo-4-methoxy-phenyl)thiazol-2-yl]carbamothioyl]-2,2-diphenyl-acetamide CAS Name: N-[[[4-(3-bromo-4-methoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-2,2-diphenylacetamide IUPAC Name: N-[[4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-2,2-diphenylacetamide Traditional Name: N-[[4-(3-bromo-4-methoxy-phenyl)thiazol-2-yl]thiocarbamoyl]-2,2-diphenyl-acetamide Formula: C25H20BrN3O2S2 MolecularWeight: 538.4792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C25H20BrN3O2S2/c1-31-21-13-12-18(14-19(21)26)20-15-33-25(27-20)29-24(32)28-23(30)22(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-15,22H,1H3,(H2,27,28,29,30,32)