5-methylsulfanyl-N-[(4-phenylmethoxyphenyl)carbamothioyl]thiophene-2-carboxamide

Systemtic Name: 5-methylsulfanyl-N-[(4-phenylmethoxyphenyl)carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[(4-benzyloxyphenyl)carbamothioyl]-5-methylsulfanyl-thiophene-2-carboxamide CAS Name: 5-(methylthio)-N-[(4-phenylmethoxyanilino)-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: 5-methylsulfanyl-N-[(4-phenylmethoxyphenyl)carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[(4-benzoxyphenyl)thiocarbamoyl]-5-(methylthio)thiophene-2-carboxamide Formula: C20H18N2O2S3 MolecularWeight: 414.56412

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(S1)C(=O)NC(=S)NC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(S1)C(=O)NC(=S)NC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H18N2O2S3/c1-26-18-12-11-17(27-18)19(23)22-20(25)21-15-7-9-16(10-8-15)24-13-14-5-3-2-4-6-14/h2-12H,13H2,1H3,(H2,21,22,23,25)