3,4,5-triethoxy-N-[[3-[(2-methylphenyl)carbonylamino]phenyl]carbamothioyl]benzamide

Systemtic Name: 3,4,5-triethoxy-N-[[3-[(2-methylphenyl)carbonylamino]phenyl]carbamothioyl]benzamide Openeye Name: 3,4,5-triethoxy-N-[[3-[(2-methylbenzoyl)amino]phenyl]carbamothioyl]benzamide CAS Name: 3,4,5-triethoxy-N-[[3-[[(2-methylphenyl)-oxomethyl]amino]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[[3-[(2-methylbenzoyl)amino]phenyl]carbamothioyl]benzamide Traditional Name: 3,4,5-triethoxy-N-[[3-(o-toluoylamino)phenyl]thiocarbamoyl]benzamide Formula: C28H31N3O5S MolecularWeight: 521.62784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C28H31N3O5S/c1-5-34-23-15-19(16-24(35-6-2)25(23)36-7-3)26(32)31-28(37)30-21-13-10-12-20(17-21)29-27(33)22-14-9-8-11-18(22)4/h8-17H,5-7H2,1-4H3,(H,29,33)(H2,30,31,32,37)