N-ethyl-3-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]-N-phenyl-benzamide

Systemtic Name: N-ethyl-3-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]-N-phenyl-benzamide Openeye Name: N-ethyl-3-[(3-isopentyloxybenzoyl)carbamothioylamino]-N-phenyl-benzamide CAS Name: N-ethyl-3-[[[[[3-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: N-ethyl-3-[[3-(3-methylbutoxy)benzoyl]carbamothioylamino]-N-phenylbenzamide Traditional Name: N-ethyl-3-[(3-isoamoxybenzoyl)thiocarbamoylamino]-N-phenyl-benzamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCC(C)C

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCC(C)C

InChI

InChI=1S/C28H31N3O3S/c1-4-31(24-13-6-5-7-14-24)27(33)22-11-8-12-23(18-22)29-28(35)30-26(32)21-10-9-15-25(19-21)34-17-16-20(2)3/h5-15,18-20H,4,16-17H2,1-3H3,(H2,29,30,32,35)