5-bromanyl-N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[[[4-(3,4-dimethoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]thiocarbamoyl]-1-naphthamide Formula: C23H18BrN3O3S2 MolecularWeight: 528.44132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Br)OC

InChI

InChI=1S/C23H18BrN3O3S2/c1-29-19-10-9-13(11-20(19)30-2)18-12-32-23(25-18)27-22(31)26-21(28)16-7-3-6-15-14(16)5-4-8-17(15)24/h3-12H,1-2H3,(H2,25,26,27,28,31)