2-[(2-pentoxyphenyl)carbonylcarbamothioylamino]-N-(1-phenylethyl)benzamide

Systemtic Name: 2-[(2-pentoxyphenyl)carbonylcarbamothioylamino]-N-(1-phenylethyl)benzamide Openeye Name: 2-[(2-pentoxybenzoyl)carbamothioylamino]-N-(1-phenylethyl)benzamide CAS Name: 2-[[[[oxo-(2-pentoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 2-[(2-pentoxybenzoyl)carbamothioylamino]-N-(1-phenylethyl)benzamide Traditional Name: 2-[(2-amoxybenzoyl)thiocarbamoylamino]-N-(1-phenylethyl)benzamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC(C)C3=CC=CC=C3

InChI

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