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

Systemtic Name: 5-bromanyl-2-methoxy-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-methyl-benzamide Openeye Name: 5-bromo-2-methoxy-N-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamothioyl]-3-methyl-benzamide CAS Name: 5-bromo-2-methoxy-N-[[[4-(4-methoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-3-methylbenzamide IUPAC Name: 5-bromo-2-methoxy-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-methylbenzamide Traditional Name: 5-bromo-2-methoxy-N-[[4-(4-methoxyphenyl)thiazol-2-yl]thiocarbamoyl]-3-methyl-benzamide Formula: C20H18BrN3O3S2 MolecularWeight: 492.40922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)OC)OC

InChI

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