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

Systemtic Name: 2-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]-N-phenyl-benzamide Openeye Name: 2-[(4-isopentyloxybenzoyl)carbamothioylamino]-N-phenyl-benzamide CAS Name: 2-[[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: 2-[[4-(3-methylbutoxy)benzoyl]carbamothioylamino]-N-phenylbenzamide Traditional Name: 2-[(4-isoamoxybenzoyl)thiocarbamoylamino]-N-phenyl-benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-18(2)16-17-32-21-14-12-19(13-15-21)24(30)29-26(33)28-23-11-7-6-10-22(23)25(31)27-20-8-4-3-5-9-20/h3-15,18H,16-17H2,1-2H3,(H,27,31)(H2,28,29,30,33)