4-(2,2-diphenylethanoylcarbamothioylamino)-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: 4-(2,2-diphenylethanoylcarbamothioylamino)-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 4-[(2,2-diphenylacetyl)carbamothioylamino]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 4-[[[(1-oxo-2,2-diphenylethyl)amino]-sulfanylidenemethyl]amino]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 4-[(2,2-diphenylacetyl)carbamothioylamino]-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 4-[(2,2-diphenylacetyl)thiocarbamoylamino]-N-(tetrahydrofurfuryl)benzamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O3S/c31-25(28-18-23-12-7-17-33-23)21-13-15-22(16-14-21)29-27(34)30-26(32)24(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-6,8-11,13-16,23-24H,7,12,17-18H2,(H,28,31)(H2,29,30,32,34)