1-(4-methylphenyl)sulfonyl-N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide Openeye Name: N-[4-(4-nitro-2-thienyl)thiazol-2-yl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[4-(4-nitro-2-thiophenyl)-2-thiazolyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide Traditional Name: N-[4-(4-nitro-2-thienyl)thiazol-2-yl]-1-tosyl-isonipecotamide Formula: C20H20N4O5S3 MolecularWeight: 492.5916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC(=CS3)C4=CC(=CS4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC(=CS3)C4=CC(=CS4)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O5S3/c1-13-2-4-16(5-3-13)32(28,29)23-8-6-14(7-9-23)19(25)22-20-21-17(12-31-20)18-10-15(11-30-18)24(26)27/h2-5,10-12,14H,6-9H2,1H3,(H,21,22,25)