3-chloranyl-N-[[4-chloranyl-3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[[4-chloranyl-3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[4-chloro-3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[4-chloro-3-[(cyclohexylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[4-chloro-3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[[4-chloro-3-(cyclohexylcarbamoyl)phenyl]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C23H21Cl2N3O2S2 MolecularWeight: 506.46774

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)Cl

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)Cl

InChI

InChI=1S/C23H21Cl2N3O2S2/c24-17-11-10-14(12-16(17)21(29)26-13-6-2-1-3-7-13)27-23(31)28-22(30)20-19(25)15-8-4-5-9-18(15)32-20/h4-5,8-13H,1-3,6-7H2,(H,26,29)(H2,27,28,30,31)