N-[2,5-diethoxy-4-(phenethylcarbamothioylamino)phenyl]benzamide

Systemtic Name: N-[2,5-diethoxy-4-(phenethylcarbamothioylamino)phenyl]benzamide Openeye Name: N-[2,5-diethoxy-4-(phenethylcarbamothioylamino)phenyl]benzamide CAS Name: N-[2,5-diethoxy-4-[[(phenethylamino)-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: N-[2,5-diethoxy-4-(phenethylcarbamothioylamino)phenyl]benzamide Traditional Name: N-[2,5-diethoxy-4-(phenethylthiocarbamoylamino)phenyl]benzamide Formula: C26H29N3O3S MolecularWeight: 463.59176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C26H29N3O3S/c1-3-31-23-18-22(29-26(33)27-16-15-19-11-7-5-8-12-19)24(32-4-2)17-21(23)28-25(30)20-13-9-6-10-14-20/h5-14,17-18H,3-4,15-16H2,1-2H3,(H,28,30)(H2,27,29,33)