3-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-cyclohexyl-benzamide

Systemtic Name: 3-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-cyclohexyl-benzamide Openeye Name: 3-[(3-butoxybenzoyl)carbamothioylamino]-N-cyclohexyl-benzamide CAS Name: 3-[[[[(3-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-cyclohexylbenzamide IUPAC Name: 3-[(3-butoxybenzoyl)carbamothioylamino]-N-cyclohexylbenzamide Traditional Name: 3-[(3-butoxybenzoyl)thiocarbamoylamino]-N-cyclohexyl-benzamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3

InChI

InChI=1S/C25H31N3O3S/c1-2-3-15-31-22-14-8-10-19(17-22)24(30)28-25(32)27-21-13-7-9-18(16-21)23(29)26-20-11-5-4-6-12-20/h7-10,13-14,16-17,20H,2-6,11-12,15H2,1H3,(H,26,29)(H2,27,28,30,32)