N-(oxolan-2-ylmethyl)-2-[(3-phenethyloxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(oxolan-2-ylmethyl)-2-[(3-phenethyloxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: 2-[(3-phenethyloxybenzoyl)carbamothioylamino]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: N-(2-oxolanylmethyl)-2-[[[[oxo-(3-phenethyloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(oxolan-2-ylmethyl)-2-[(3-phenethyloxybenzoyl)carbamothioylamino]benzamide Traditional Name: 2-[(3-phenethyloxybenzoyl)thiocarbamoylamino]-N-(tetrahydrofurfuryl)benzamide Formula: C28H29N3O4S MolecularWeight: 503.61256

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC=C3)OCCC4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC=C3)OCCC4=CC=CC=C4

InChI

InChI=1S/C28H29N3O4S/c32-26(21-10-6-11-22(18-21)35-17-15-20-8-2-1-3-9-20)31-28(36)30-25-14-5-4-13-24(25)27(33)29-19-23-12-7-16-34-23/h1-6,8-11,13-14,18,23H,7,12,15-17,19H2,(H,29,33)(H2,30,31,32,36)