N-tert-butyl-3-[(4-pentoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-tert-butyl-3-[(4-pentoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-tert-butyl-3-[(4-pentoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-tert-butyl-3-[[[[oxo-(4-pentoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-tert-butyl-3-[(4-pentoxybenzoyl)carbamothioylamino]benzamide Traditional Name: 3-[(4-amoxybenzoyl)thiocarbamoylamino]-N-tert-butyl-benzamide Formula: C24H31N3O3S MolecularWeight: 441.58624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)(C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)(C)C

InChI

InChI=1S/C24H31N3O3S/c1-5-6-7-15-30-20-13-11-17(12-14-20)21(28)26-23(31)25-19-10-8-9-18(16-19)22(29)27-24(2,3)4/h8-14,16H,5-7,15H2,1-4H3,(H,27,29)(H2,25,26,28,31)