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

Systemtic Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-3,4,5-triethoxy-benzamide Openeye Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-3,4,5-triethoxy-benzamide CAS Name: 3,4,5-triethoxy-N-[[3-(1-oxobutylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-3,4,5-triethoxybenzamide Traditional Name: N-[(3-butyramidophenyl)thiocarbamoyl]-3,4,5-triethoxy-benzamide Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=C(C(=C2)OCC)OCC)OCC

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=C(C(=C2)OCC)OCC)OCC

InChI

InChI=1S/C24H31N3O5S/c1-5-10-21(28)25-17-11-9-12-18(15-17)26-24(33)27-23(29)16-13-19(30-6-2)22(32-8-4)20(14-16)31-7-3/h9,11-15H,5-8,10H2,1-4H3,(H,25,28)(H2,26,27,29,33)