3-bromanyl-N-[(3-chlorophenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide

Systemtic Name: 3-bromanyl-N-[(3-chlorophenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: 3-bromo-N-[(3-chlorophenyl)carbamothioyl]-4-isopentyloxy-benzamide CAS Name: 3-bromo-N-[(3-chloroanilino)-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: 3-bromo-N-[(3-chlorophenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: 3-bromo-N-[(3-chlorophenyl)thiocarbamoyl]-4-isoamoxy-benzamide Formula: C19H20BrClN2O2S MolecularWeight: 455.7963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)Cl)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)Cl)Br

InChI

InChI=1S/C19H20BrClN2O2S/c1-12(2)8-9-25-17-7-6-13(10-16(17)20)18(24)23-19(26)22-15-5-3-4-14(21)11-15/h3-7,10-12H,8-9H2,1-2H3,(H2,22,23,24,26)