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

Systemtic Name: N-phenethyl-2-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-phenethyl-2-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide CAS Name: 2-[[[[oxo-[4-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]-N-phenethylbenzamide IUPAC Name: N-phenethyl-2-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-phenethyl-2-[[4-(2-phenoxyethoxy)benzoyl]thiocarbamoylamino]benzamide Formula: C31H29N3O4S MolecularWeight: 539.64466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)OCCOC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)OCCOC4=CC=CC=C4

InChI

InChI=1S/C31H29N3O4S/c35-29(24-15-17-26(18-16-24)38-22-21-37-25-11-5-2-6-12-25)34-31(39)33-28-14-8-7-13-27(28)30(36)32-20-19-23-9-3-1-4-10-23/h1-18H,19-22H2,(H,32,36)(H2,33,34,35,39)