N-(3-oxidanylpropyl)-2-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(3-oxidanylpropyl)-2-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-(3-hydroxypropyl)-2-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide CAS Name: N-(3-hydroxypropyl)-2-[[[[oxo-[4-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-hydroxypropyl)-2-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-(3-hydroxypropyl)-2-[[4-(2-phenoxyethoxy)benzoyl]thiocarbamoylamino]benzamide Formula: C26H27N3O5S MolecularWeight: 493.57468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=CC=C3C(=O)NCCCO

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=CC=C3C(=O)NCCCO

InChI

InChI=1S/C26H27N3O5S/c30-16-6-15-27-25(32)22-9-4-5-10-23(22)28-26(35)29-24(31)19-11-13-21(14-12-19)34-18-17-33-20-7-2-1-3-8-20/h1-5,7-14,30H,6,15-18H2,(H,27,32)(H2,28,29,31,35)