3-bromanyl-4-ethoxy-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[[[4-(4-methoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[[4-(4-methoxyphenyl)thiazol-2-yl]thiocarbamoyl]benzamide Formula: C20H18BrN3O3S2 MolecularWeight: 492.40922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)OC)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)OC)Br

InChI

InChI=1S/C20H18BrN3O3S2/c1-3-27-17-9-6-13(10-15(17)21)18(25)23-19(28)24-20-22-16(11-29-20)12-4-7-14(26-2)8-5-12/h4-11H,3H2,1-2H3,(H2,22,23,24,25,28)