2-[1-(3-chloranyl-4-methyl-phenyl)sulfonylpiperidin-4-yl]-N-[(2-nitrophenyl)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[1-(3-chloranyl-4-methyl-phenyl)sulfonylpiperidin-4-yl]-N-[(2-nitrophenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-(3-chloro-4-methyl-phenyl)sulfonyl-4-piperidyl]-N-[(2-nitrophenyl)methyl]thiazole-4-carboxamide CAS Name: 2-[1-(3-chloro-4-methylphenyl)sulfonyl-4-piperidinyl]-N-[(2-nitrophenyl)methyl]-4-thiazolecarboxamide IUPAC Name: 2-[1-(3-chloro-4-methylphenyl)sulfonylpiperidin-4-yl]-N-[(2-nitrophenyl)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-(3-chloro-4-methyl-phenyl)sulfonyl-4-piperidyl]-N-(2-nitrobenzyl)thiazole-4-carboxamide Formula: C23H23ClN4O5S2 MolecularWeight: 535.03552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NCC4=CC=CC=C4[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NCC4=CC=CC=C4[N+](=O)[O-])Cl

InChI

InChI=1S/C23H23ClN4O5S2/c1-15-6-7-18(12-19(15)24)35(32,33)27-10-8-16(9-11-27)23-26-20(14-34-23)22(29)25-13-17-4-2-3-5-21(17)28(30)31/h2-7,12,14,16H,8-11,13H2,1H3,(H,25,29)