1-(2-cyclohexylethyl)-3-(3-pyridin-4-ylpropyl)-1-(2-sulfanylethyl)urea hydrochloride

Systemtic Name: 1-(2-cyclohexylethyl)-3-(3-pyridin-4-ylpropyl)-1-(2-sulfanylethyl)urea hydrochloride Openeye Name: 1-(2-cyclohexylethyl)-3-[3-(4-pyridyl)propyl]-1-(2-sulfanylethyl)urea hydrochloride CAS Name: 1-(2-cyclohexylethyl)-1-(2-mercaptoethyl)-3-(3-pyridin-4-ylpropyl)urea hydrochloride IUPAC Name: 1-(2-cyclohexylethyl)-3-(3-pyridin-4-ylpropyl)-1-(2-sulfanylethyl)urea hydrochloride Traditional Name: 1-(2-cyclohexylethyl)-1-(2-mercaptoethyl)-3-[3-(4-pyridyl)propyl]urea hydrochloride Formula: C19H32ClN3OS MolecularWeight: 385.99488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCN(CCS)C(=O)NCCCC2=CC=NC=C2.Cl

Isomeric SMILES

C1CCC(CC1)CCN(CCS)C(=O)NCCCC2=CC=NC=C2.Cl

InChI

InChI=1S/C19H31N3OS.ClH/c23-19(21-11-4-7-18-8-12-20-13-9-18)22(15-16-24)14-10-17-5-2-1-3-6-17;/h8-9,12-13,17,24H,1-7,10-11,14-16H2,(H,21,23);1H