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

Systemtic Name: 3-[(4-hexoxyphenyl)carbonylcarbamothioylamino]-N-methyl-N-phenyl-benzamide Openeye Name: 3-[(4-hexoxybenzoyl)carbamothioylamino]-N-methyl-N-phenyl-benzamide CAS Name: 3-[[[[(4-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-methyl-N-phenylbenzamide IUPAC Name: 3-[(4-hexoxybenzoyl)carbamothioylamino]-N-methyl-N-phenylbenzamide Traditional Name: 3-[(4-hexoxybenzoyl)thiocarbamoylamino]-N-methyl-N-phenyl-benzamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(C)C3=CC=CC=C3

InChI

InChI=1S/C28H31N3O3S/c1-3-4-5-9-19-34-25-17-15-21(16-18-25)26(32)30-28(35)29-23-12-10-11-22(20-23)27(33)31(2)24-13-7-6-8-14-24/h6-8,10-18,20H,3-5,9,19H2,1-2H3,(H2,29,30,32,35)