2-[(4-butoxyphenyl)carbonylcarbamothioyl-methyl-amino]-N-cyclohexyl-benzamide

Systemtic Name: 2-[(4-butoxyphenyl)carbonylcarbamothioyl-methyl-amino]-N-cyclohexyl-benzamide Openeye Name: 2-[(4-butoxybenzoyl)carbamothioyl-methyl-amino]-N-cyclohexyl-benzamide CAS Name: 2-[[[[(4-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]-methylamino]-N-cyclohexylbenzamide IUPAC Name: 2-[(4-butoxybenzoyl)carbamothioyl-methylamino]-N-cyclohexylbenzamide Traditional Name: 2-[(4-butoxybenzoyl)thiocarbamoyl-methyl-amino]-N-cyclohexyl-benzamide Formula: C26H33N3O3S MolecularWeight: 467.62352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NC3CCCCC3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NC3CCCCC3

InChI

InChI=1S/C26H33N3O3S/c1-3-4-18-32-21-16-14-19(15-17-21)24(30)28-26(33)29(2)23-13-9-8-12-22(23)25(31)27-20-10-6-5-7-11-20/h8-9,12-17,20H,3-7,10-11,18H2,1-2H3,(H,27,31)(H,28,30,33)