(4R)-N-methyl-N-(phenylmethyl)-2-pyridin-1-ium-3-yl-1,3-thiazolidin-3-ium-4-carboxamide dichloride

Systemtic Name: (4R)-N-methyl-N-(phenylmethyl)-2-pyridin-1-ium-3-yl-1,3-thiazolidin-3-ium-4-carboxamide dichloride Openeye Name: (4R)-N-benzyl-N-methyl-2-pyridin-1-ium-3-yl-thiazolidin-3-ium-4-carboxamide dichloride CAS Name: (4R)-N-methyl-N-(phenylmethyl)-2-(3-pyridin-1-iumyl)-4-thiazolidin-3-iumcarboxamide dichloride IUPAC Name: (4R)-N-benzyl-N-methyl-2-pyridin-1-ium-3-yl-1,3-thiazolidin-3-ium-4-carboxamide dichloride Traditional Name: (4R)-N-benzyl-N-methyl-2-pyridin-1-ium-3-yl-thiazolidin-3-ium-4-carboxamide dichloride Formula: C17H21Cl2N3OS MolecularWeight: 386.33914

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2CSC([NH2+]2)C3=C[NH+]=CC=C3.[Cl-].[Cl-]

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)[C@@H]2CSC([NH2+]2)C3=C[NH+]=CC=C3.[Cl-].[Cl-]

InChI

InChI=1S/C17H19N3OS.2ClH/c1-20(11-13-6-3-2-4-7-13)17(21)15-12-22-16(19-15)14-8-5-9-18-10-14;;/h2-10,15-16,19H,11-12H2,1H3;2*1H/t15-,16?;;/m0../s1