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

Systemtic Name: N-ethyl-2-[(4-pentoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-ethyl-2-[(4-pentoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-ethyl-2-[[[[oxo-(4-pentoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-ethyl-2-[(4-pentoxybenzoyl)carbamothioylamino]benzamide Traditional Name: 2-[(4-amoxybenzoyl)thiocarbamoylamino]-N-ethyl-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC

InChI

InChI=1S/C22H27N3O3S/c1-3-5-8-15-28-17-13-11-16(12-14-17)20(26)25-22(29)24-19-10-7-6-9-18(19)21(27)23-4-2/h6-7,9-14H,3-5,8,15H2,1-2H3,(H,23,27)(H2,24,25,26,29)