1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-(4-methylthiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-(4-methyl-2-thiazolyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-(4-methylthiazol-2-yl)isonipecotamide Formula: C16H17ClN4O5S2 MolecularWeight: 444.91298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CSC(=N1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H17ClN4O5S2/c1-10-9-27-16(18-10)19-15(22)11-4-6-20(7-5-11)28(25,26)14-8-12(21(23)24)2-3-13(14)17/h2-3,8-9,11H,4-7H2,1H3,(H,18,19,22)