1-pyrazol-1-yl-3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propan-2-ol

Systemtic Name: 1-pyrazol-1-yl-3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propan-2-ol Openeye Name: 1-pyrazol-1-yl-3-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]propan-2-ol CAS Name: 1-(1-pyrazolyl)-3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]-2-propanol IUPAC Name: 1-pyrazol-1-yl-3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propan-2-ol Traditional Name: 1-pyrazol-1-yl-3-[4-(2-thenyl)-1,4-diazepan-1-yl]propan-2-ol Formula: C16H24N4OS MolecularWeight: 320.45296

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC(CN2C=CC=N2)O)CC3=CC=CS3

Isomeric SMILES

C1CN(CCN(C1)CC(CN2C=CC=N2)O)CC3=CC=CS3

InChI

InChI=1S/C16H24N4OS/c21-15(13-20-8-2-5-17-20)12-18-6-3-7-19(10-9-18)14-16-4-1-11-22-16/h1-2,4-5,8,11,15,21H,3,6-7,9-10,12-14H2