N-cyclohexyl-3-[(4-hexoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-cyclohexyl-3-[(4-hexoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-cyclohexyl-3-[(4-hexoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-cyclohexyl-3-[[[[(4-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-3-[(4-hexoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-cyclohexyl-3-[(4-hexoxybenzoyl)thiocarbamoylamino]benzamide Formula: C27H35N3O3S MolecularWeight: 481.6501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3

InChI

InChI=1S/C27H35N3O3S/c1-2-3-4-8-18-33-24-16-14-20(15-17-24)25(31)30-27(34)29-23-13-9-10-21(19-23)26(32)28-22-11-6-5-7-12-22/h9-10,13-17,19,22H,2-8,11-12,18H2,1H3,(H,28,32)(H2,29,30,31,34)