3-[(4-butan-2-yloxyphenyl)carbonylcarbamothioylamino]-N-cyclohexyl-benzamide

Systemtic Name: 3-[(4-butan-2-yloxyphenyl)carbonylcarbamothioylamino]-N-cyclohexyl-benzamide Openeye Name: N-cyclohexyl-3-[(4-sec-butoxybenzoyl)carbamothioylamino]benzamide CAS Name: 3-[[[[(4-butan-2-yloxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-cyclohexylbenzamide IUPAC Name: 3-[(4-butan-2-yloxybenzoyl)carbamothioylamino]-N-cyclohexylbenzamide Traditional Name: N-cyclohexyl-3-[(4-sec-butoxybenzoyl)thiocarbamoylamino]benzamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3

InChI

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