N-(1-phenylethyl)-4-[(4-propoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(1-phenylethyl)-4-[(4-propoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(1-phenylethyl)-4-[(4-propoxybenzoyl)carbamothioylamino]benzamide CAS Name: 4-[[[[oxo-(4-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: N-(1-phenylethyl)-4-[(4-propoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(1-phenylethyl)-4-[(4-propoxybenzoyl)thiocarbamoylamino]benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-3-17-32-23-15-11-21(12-16-23)25(31)29-26(33)28-22-13-9-20(10-14-22)24(30)27-18(2)19-7-5-4-6-8-19/h4-16,18H,3,17H2,1-2H3,(H,27,30)(H2,28,29,31,33)