2-[(2-pentoxyphenyl)carbonylcarbamothioylamino]-N-phenethyl-benzamide

Systemtic Name: 2-[(2-pentoxyphenyl)carbonylcarbamothioylamino]-N-phenethyl-benzamide Openeye Name: 2-[(2-pentoxybenzoyl)carbamothioylamino]-N-phenethyl-benzamide CAS Name: 2-[[[[oxo-(2-pentoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[(2-pentoxybenzoyl)carbamothioylamino]-N-phenethylbenzamide Traditional Name: 2-[(2-amoxybenzoyl)thiocarbamoylamino]-N-phenethyl-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)NCCC3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3

InChI

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