thiophen-2-yl 3-(azepan-1-ylmethyl)-1,2,4-oxadiazole-5-carboxylate hydrochloride

Systemtic Name: thiophen-2-yl 3-(azepan-1-ylmethyl)-1,2,4-oxadiazole-5-carboxylate hydrochloride Openeye Name: 2-thienyl 3-(azepan-1-ylmethyl)-1,2,4-oxadiazole-5-carboxylate hydrochloride CAS Name: 3-(1-azepanylmethyl)-1,2,4-oxadiazole-5-carboxylic acid thiophen-2-yl ester hydrochloride IUPAC Name: thiophen-2-yl 3-(azepan-1-ylmethyl)-1,2,4-oxadiazole-5-carboxylate hydrochloride Traditional Name: 3-(azepan-1-ylmethyl)-1,2,4-oxadiazole-5-carboxylic acid 2-thienyl ester hydrochloride Formula: C14H18ClN3O3S MolecularWeight: 343.82902

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=NOC(=N2)C(=O)OC3=CC=CS3.Cl

Isomeric SMILES

C1CCCN(CC1)CC2=NOC(=N2)C(=O)OC3=CC=CS3.Cl

InChI

InChI=1S/C14H17N3O3S.ClH/c18-14(19-12-6-5-9-21-12)13-15-11(16-20-13)10-17-7-3-1-2-4-8-17;/h5-6,9H,1-4,7-8,10H2;1H