3-chloranyl-N-[[3-[(3-methylphenyl)carbamoyl]phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[[3-[(3-methylphenyl)carbamoyl]phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[3-(m-tolylcarbamoyl)phenyl]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[3-[(3-methylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[3-[(3-methylphenyl)carbamoyl]phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[[3-(m-tolylcarbamoyl)phenyl]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C24H18ClN3O2S2 MolecularWeight: 480.00162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C24H18ClN3O2S2/c1-14-6-4-8-16(12-14)26-22(29)15-7-5-9-17(13-15)27-24(31)28-23(30)21-20(25)18-10-2-3-11-19(18)32-21/h2-13H,1H3,(H,26,29)(H2,27,28,30,31)