4-[4-(azepan-1-ylsulfonyl)phenyl]-2-pyrrolidin-1-yl-1,3-thiazole hydrochloride

Systemtic Name: 4-[4-(azepan-1-ylsulfonyl)phenyl]-2-pyrrolidin-1-yl-1,3-thiazole hydrochloride Openeye Name: 4-[4-(azepan-1-ylsulfonyl)phenyl]-2-pyrrolidin-1-yl-thiazole hydrochloride CAS Name: 4-[4-(1-azepanylsulfonyl)phenyl]-2-(1-pyrrolidinyl)thiazole hydrochloride IUPAC Name: 4-[4-(azepan-1-ylsulfonyl)phenyl]-2-pyrrolidin-1-yl-1,3-thiazole hydrochloride Traditional Name: 4-[4-(azepan-1-ylsulfonyl)phenyl]-2-pyrrolidino-thiazole hydrochloride Formula: C19H26ClN3O2S2 MolecularWeight: 428.01164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)N4CCCC4.Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)N4CCCC4.Cl

InChI

InChI=1S/C19H25N3O2S2.ClH/c23-26(24,22-13-3-1-2-4-14-22)17-9-7-16(8-10-17)18-15-25-19(20-18)21-11-5-6-12-21;/h7-10,15H,1-6,11-14H2;1H