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

Systemtic Name: N-methyl-3-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-[(4-isopentyloxybenzoyl)carbamothioylamino]-N-methyl-benzamide CAS Name: N-methyl-3-[[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-methyl-3-[[4-(3-methylbutoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-benzyl-3-[(4-isoamoxybenzoyl)thiocarbamoylamino]-N-methyl-benzamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C28H31N3O3S/c1-20(2)16-17-34-25-14-12-22(13-15-25)26(32)30-28(35)29-24-11-7-10-23(18-24)27(33)31(3)19-21-8-5-4-6-9-21/h4-15,18,20H,16-17,19H2,1-3H3,(H2,29,30,32,35)