N-(4-ethoxyphenyl)-2-[(2-pentoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[(2-pentoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(4-ethoxyphenyl)-2-[(2-pentoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(4-ethoxyphenyl)-2-[[[[oxo-(2-pentoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(4-ethoxyphenyl)-2-[(2-pentoxybenzoyl)carbamothioylamino]benzamide Traditional Name: 2-[(2-amoxybenzoyl)thiocarbamoylamino]-N-p-phenetyl-benzamide Formula: C28H31N3O4S MolecularWeight: 505.62844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C28H31N3O4S/c1-3-5-10-19-35-25-14-9-7-12-23(25)27(33)31-28(36)30-24-13-8-6-11-22(24)26(32)29-20-15-17-21(18-16-20)34-4-2/h6-9,11-18H,3-5,10,19H2,1-2H3,(H,29,32)(H2,30,31,33,36)