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

Systemtic Name: 1-methyl-3-[4-(2-methylpentan-2-ylsulfanyl)phenyl]-1-(1-methylpiperidin-4-yl)urea Openeye Name: 3-[4-(1,1-dimethylbutylsulfanyl)phenyl]-1-methyl-1-(1-methyl-4-piperidyl)urea CAS Name: 1-methyl-3-[4-(2-methylpentan-2-ylthio)phenyl]-1-(1-methyl-4-piperidinyl)urea IUPAC Name: 1-methyl-3-[4-(2-methylpentan-2-ylsulfanyl)phenyl]-1-(1-methylpiperidin-4-yl)urea Traditional Name: 3-[4-(1,1-dimethylbutylthio)phenyl]-1-methyl-1-(1-methyl-4-piperidyl)urea Formula: C20H33N3OS MolecularWeight: 363.56052

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)SC1=CC=C(C=C1)NC(=O)N(C)C2CCN(CC2)C

Isomeric SMILES

CCCC(C)(C)SC1=CC=C(C=C1)NC(=O)N(C)C2CCN(CC2)C

InChI

InChI=1S/C20H33N3OS/c1-6-13-20(2,3)25-18-9-7-16(8-10-18)21-19(24)23(5)17-11-14-22(4)15-12-17/h7-10,17H,6,11-15H2,1-5H3,(H,21,24)