N-[(4-acetamidophenyl)carbamothioyl]-3,4,5-triethoxy-benzamide

Systemtic Name: N-[(4-acetamidophenyl)carbamothioyl]-3,4,5-triethoxy-benzamide Openeye Name: N-[(4-acetamidophenyl)carbamothioyl]-3,4,5-triethoxy-benzamide CAS Name: N-[(4-acetamidoanilino)-sulfanylidenemethyl]-3,4,5-triethoxybenzamide IUPAC Name: N-[(4-acetamidophenyl)carbamothioyl]-3,4,5-triethoxybenzamide Traditional Name: N-[(4-acetamidophenyl)thiocarbamoyl]-3,4,5-triethoxy-benzamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C22H27N3O5S/c1-5-28-18-12-15(13-19(29-6-2)20(18)30-7-3)21(27)25-22(31)24-17-10-8-16(9-11-17)23-14(4)26/h8-13H,5-7H2,1-4H3,(H,23,26)(H2,24,25,27,31)