5-bromanyl-N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[[4-(2-cyclohexylethoxy)anilino]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[[4-(2-cyclohexylethoxy)phenyl]thiocarbamoyl]-2-methoxy-benzamide Formula: C23H27BrN2O3S MolecularWeight: 491.44108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)OCCC3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)OCCC3CCCCC3

InChI

InChI=1S/C23H27BrN2O3S/c1-28-21-12-7-17(24)15-20(21)22(27)26-23(30)25-18-8-10-19(11-9-18)29-14-13-16-5-3-2-4-6-16/h7-12,15-16H,2-6,13-14H2,1H3,(H2,25,26,27,30)