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

Systemtic Name: N-(3-methoxypropyl)-2-[[2-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-(3-methoxypropyl)-2-[[2-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide CAS Name: N-(3-methoxypropyl)-2-[[[[oxo-[2-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-methoxypropyl)-2-[[2-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-(3-methoxypropyl)-2-[[2-(2-phenoxyethoxy)benzoyl]thiocarbamoylamino]benzamide Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3

Isomeric SMILES

COCCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O5S/c1-33-17-9-16-28-25(31)21-12-5-7-14-23(21)29-27(36)30-26(32)22-13-6-8-15-24(22)35-19-18-34-20-10-3-2-4-11-20/h2-8,10-15H,9,16-19H2,1H3,(H,28,31)(H2,29,30,32,36)