1-methyl-3-[4-(2-methylpentan-2-ylsulfanyl)phenyl]-1-piperidin-4-yl-urea

Systemtic Name: 1-methyl-3-[4-(2-methylpentan-2-ylsulfanyl)phenyl]-1-piperidin-4-yl-urea Openeye Name: 3-[4-(1,1-dimethylbutylsulfanyl)phenyl]-1-methyl-1-(4-piperidyl)urea CAS Name: 1-methyl-3-[4-(2-methylpentan-2-ylthio)phenyl]-1-(4-piperidinyl)urea IUPAC Name: 1-methyl-3-[4-(2-methylpentan-2-ylsulfanyl)phenyl]-1-piperidin-4-ylurea Traditional Name: 3-[4-(1,1-dimethylbutylthio)phenyl]-1-methyl-1-(4-piperidyl)urea Formula: C19H31N3OS MolecularWeight: 349.53394

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)SC1=CC=C(C=C1)NC(=O)N(C)C2CCNCC2

Isomeric SMILES

CCCC(C)(C)SC1=CC=C(C=C1)NC(=O)N(C)C2CCNCC2

InChI

InChI=1S/C19H31N3OS/c1-5-12-19(2,3)24-17-8-6-15(7-9-17)21-18(23)22(4)16-10-13-20-14-11-16/h6-9,16,20H,5,10-14H2,1-4H3,(H,21,23)