5-chloranyl-3-methyl-N-[(3-phenoxyphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-[(3-phenoxyphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 5-chloro-3-methyl-N-[(3-phenoxyphenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 5-chloro-3-methyl-N-[(3-phenoxyanilino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 5-chloro-3-methyl-N-[(3-phenoxyphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 5-chloro-3-methyl-N-[(3-phenoxyphenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C23H17ClN2O2S2 MolecularWeight: 452.97628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)C(=O)NC(=S)NC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)C(=O)NC(=S)NC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C23H17ClN2O2S2/c1-14-19-12-15(24)10-11-20(19)30-21(14)22(27)26-23(29)25-16-6-5-9-18(13-16)28-17-7-3-2-4-8-17/h2-13H,1H3,(H2,25,26,27,29)