methyl 2-(4-azanylazepan-1-yl)-1,3-thiazole-5-carboxylate hydrochloride

Systemtic Name: methyl 2-(4-azanylazepan-1-yl)-1,3-thiazole-5-carboxylate hydrochloride Openeye Name: methyl 2-(4-aminoazepan-1-yl)thiazole-5-carboxylate hydrochloride CAS Name: 2-(4-amino-1-azepanyl)-5-thiazolecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 2-(4-aminoazepan-1-yl)-1,3-thiazole-5-carboxylate hydrochloride Traditional Name: 2-(4-aminoazepan-1-yl)thiazole-5-carboxylic acid methyl ester hydrochloride Formula: C11H18ClN3O2S MolecularWeight: 291.79752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(S1)N2CCCC(CC2)N.Cl

Isomeric SMILES

COC(=O)C1=CN=C(S1)N2CCCC(CC2)N.Cl

InChI

InChI=1S/C11H17N3O2S.ClH/c1-16-10(15)9-7-13-11(17-9)14-5-2-3-8(12)4-6-14;/h7-8H,2-6,12H2,1H3;1H