2-chloranyl-N-[(4-sulfanylphenyl)carbamoyl]benzamide; 1-chloranyl-3-(trifluoromethyl)benzene

Systemtic Name: 2-chloranyl-N-[(4-sulfanylphenyl)carbamoyl]benzamide; 1-chloranyl-3-(trifluoromethyl)benzene Openeye Name: 2-chloro-N-[(4-sulfanylphenyl)carbamoyl]benzamide; 1-chloro-3-(trifluoromethyl)benzene CAS Name: 2-chloro-N-[(4-mercaptoanilino)-oxomethyl]benzamide; 1-chloro-3-(trifluoromethyl)benzene IUPAC Name: 2-chloro-N-[(4-sulfanylphenyl)carbamoyl]benzamide; 1-chloro-3-(trifluoromethyl)benzene Traditional Name: 2-chloro-N-[(4-mercaptophenyl)carbamoyl]benzamide; 1-chloro-3-(trifluoromethyl)benzene Formula: C21H15Cl2F3N2O2S MolecularWeight: 487.32221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=O)NC2=CC=C(C=C2)S)Cl.C1=CC(=CC(=C1)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=O)NC2=CC=C(C=C2)S)Cl.C1=CC(=CC(=C1)Cl)C(F)(F)F

InChI

InChI=1S/C14H11ClN2O2S.C7H4ClF3/c15-12-4-2-1-3-11(12)13(18)17-14(19)16-9-5-7-10(20)8-6-9;8-6-3-1-2-5(4-6)7(9,10)11/h1-8,20H,(H2,16,17,18,19);1-4H