4-(2,2-diphenylethanoylcarbamothioylamino)-N-(3-methoxypropyl)benzamide

Systemtic Name: 4-(2,2-diphenylethanoylcarbamothioylamino)-N-(3-methoxypropyl)benzamide Openeye Name: 4-[(2,2-diphenylacetyl)carbamothioylamino]-N-(3-methoxypropyl)benzamide CAS Name: N-(3-methoxypropyl)-4-[[[(1-oxo-2,2-diphenylethyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 4-[(2,2-diphenylacetyl)carbamothioylamino]-N-(3-methoxypropyl)benzamide Traditional Name: 4-[(2,2-diphenylacetyl)thiocarbamoylamino]-N-(3-methoxypropyl)benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COCCCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-32-18-8-17-27-24(30)21-13-15-22(16-14-21)28-26(33)29-25(31)23(19-9-4-2-5-10-19)20-11-6-3-7-12-20/h2-7,9-16,23H,8,17-18H2,1H3,(H,27,30)(H2,28,29,31,33)