N-butyl-3-[(3-phenethyloxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-butyl-3-[(3-phenethyloxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-butyl-3-[(3-phenethyloxybenzoyl)carbamothioylamino]benzamide CAS Name: N-butyl-3-[[[[oxo-(3-phenethyloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butyl-3-[(3-phenethyloxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-butyl-3-[(3-phenethyloxybenzoyl)thiocarbamoylamino]benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-2-3-16-28-25(31)21-11-7-13-23(18-21)29-27(34)30-26(32)22-12-8-14-24(19-22)33-17-15-20-9-5-4-6-10-20/h4-14,18-19H,2-3,15-17H2,1H3,(H,28,31)(H2,29,30,32,34)