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

Systemtic Name: N-ethyl-2-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]-N-phenyl-benzamide Openeye Name: N-ethyl-2-[(3-isopentyloxybenzoyl)carbamothioylamino]-N-phenyl-benzamide CAS Name: N-ethyl-2-[[[[[3-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: N-ethyl-2-[[3-(3-methylbutoxy)benzoyl]carbamothioylamino]-N-phenylbenzamide Traditional Name: N-ethyl-2-[(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=C2NC(=S)NC(=O)C3=CC(=CC=C3)OCCC(C)C

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC=C3)OCCC(C)C

InChI

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