N-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[4-(3-bromophenyl)thiazol-2-yl]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[[4-(3-bromophenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[4-(3-bromophenyl)thiazol-2-yl]thiocarbamoyl]cyclohexanecarboxamide Formula: C17H18BrN3OS2 MolecularWeight: 424.37832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CCC(CC1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H18BrN3OS2/c18-13-8-4-7-12(9-13)14-10-24-17(19-14)21-16(23)20-15(22)11-5-2-1-3-6-11/h4,7-11H,1-3,5-6H2,(H2,19,20,21,22,23)