N-[3-[1-[3-(tert-butylcarbamothioylamino)propyl]piperidin-4-yl]phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-[1-[3-(tert-butylcarbamothioylamino)propyl]piperidin-4-yl]phenyl]-2-methyl-propanamide Openeye Name: N-[3-[1-[3-(tert-butylcarbamothioylamino)propyl]-4-piperidyl]phenyl]-2-methyl-propanamide CAS Name: N-[3-[1-[3-[[(tert-butylamino)-sulfanylidenemethyl]amino]propyl]-4-piperidinyl]phenyl]-2-methylpropanamide IUPAC Name: N-[3-[1-[3-(tert-butylcarbamothioylamino)propyl]piperidin-4-yl]phenyl]-2-methylpropanamide Traditional Name: N-[3-[1-[3-(tert-butylthiocarbamoylamino)propyl]-4-piperidyl]phenyl]-2-methyl-propionamide Formula: C23H38N4OS MolecularWeight: 418.63902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCCNC(=S)NC(C)(C)C

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCCNC(=S)NC(C)(C)C

InChI

InChI=1S/C23H38N4OS/c1-17(2)21(28)25-20-9-6-8-19(16-20)18-10-14-27(15-11-18)13-7-12-24-22(29)26-23(3,4)5/h6,8-9,16-18H,7,10-15H2,1-5H3,(H,25,28)(H2,24,26,29)