6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[1-(2-methyl-5-nitro-phenyl)sulfonyl-4-piperidyl]methanone CAS Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[1-(2-methyl-5-nitrophenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[1-(2-methyl-5-nitro-phenyl)sulfonyl-4-piperidyl]methanone Formula: C20H23N3O5S2 MolecularWeight: 449.54372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)N3CCC4=C(C3)C=CS4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)N3CCC4=C(C3)C=CS4

InChI

InChI=1S/C20H23N3O5S2/c1-14-2-3-17(23(25)26)12-19(14)30(27,28)22-9-4-15(5-10-22)20(24)21-8-6-18-16(13-21)7-11-29-18/h2-3,7,11-12,15H,4-6,8-10,13H2,1H3