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

Systemtic Name: 3-chloranyl-N-[[3-[(phenylmethyl)carbamoyl]phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[[3-(benzylcarbamoyl)phenyl]carbamothioyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[3-[oxo-[(phenylmethyl)amino]methyl]anilino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[[3-(benzylcarbamoyl)phenyl]carbamothioyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[[3-(benzylcarbamoyl)phenyl]thiocarbamoyl]-3-chloro-benzothiophene-2-carboxamide Formula: C24H18ClN3O2S2 MolecularWeight: 480.00162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H18ClN3O2S2/c25-20-18-11-4-5-12-19(18)32-21(20)23(30)28-24(31)27-17-10-6-9-16(13-17)22(29)26-14-15-7-2-1-3-8-15/h1-13H,14H2,(H,26,29)(H2,27,28,30,31)