4-[[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methylamino]cyclohexan-1-ol hydrochloride

Systemtic Name: 4-[[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methylamino]cyclohexan-1-ol hydrochloride Openeye Name: 4-[[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methylamino]cyclohexanol hydrochloride CAS Name: 4-[[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]methylamino]-1-cyclohexanol hydrochloride IUPAC Name: 4-[(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)methylamino]cyclohexan-1-ol hydrochloride Traditional Name: 4-[[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methylamino]cyclohexanol hydrochloride Formula: C21H26ClN3OS MolecularWeight: 403.96864

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NCC2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)O.Cl

Isomeric SMILES

C1CC(CCC1NCC2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)O.Cl

InChI

InChI=1S/C21H25N3OS.ClH/c25-19-10-8-18(9-11-19)22-13-17-15-24(14-16-5-2-1-3-6-16)23-21(17)20-7-4-12-26-20;/h1-7,12,15,18-19,22,25H,8-11,13-14H2;1H