[(3S)-1-imidazo[2,1-b][1,3]thiazol-6-ylcarbonylpiperidin-3-yl]-methyl-phenethyl-azanium

Systemtic Name: [(3S)-1-imidazo[2,1-b][1,3]thiazol-6-ylcarbonylpiperidin-3-yl]-methyl-phenethyl-azanium Openeye Name: [(3S)-1-(imidazo[2,1-b]thiazole-6-carbonyl)-3-piperidyl]-methyl-phenethyl-ammonium CAS Name: [(3S)-1-[6-imidazo[2,1-b]thiazolyl(oxo)methyl]-3-piperidinyl]-methyl-phenethylammonium IUPAC Name: [(3S)-1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]-methyl-phenethylazanium Traditional Name: [(3S)-1-(imidazo[2,1-b]thiazole-6-carbonyl)-3-piperidyl]-methyl-phenethyl-ammonium Formula: C20H25N4OS+ MolecularWeight: 369.5037

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCCN(C2)C(=O)C3=CN4C=CSC4=N3

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)[C@H]2CCCN(C2)C(=O)C3=CN4C=CSC4=N3

InChI

InChI=1S/C20H24N4OS/c1-22(11-9-16-6-3-2-4-7-16)17-8-5-10-23(14-17)19(25)18-15-24-12-13-26-20(24)21-18/h2-4,6-7,12-13,15,17H,5,8-11,14H2,1H3/p+1/t17-/m0/s1