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

Systemtic Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[1-(4-imidazol-1-yl-3-nitro-phenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[1-(4-imidazol-1-yl-3-nitro-phenyl)sulfonyl-4-piperidyl]methanone CAS Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[1-[4-(1-imidazolyl)-3-nitrophenyl]sulfonyl-4-piperidinyl]methanone IUPAC Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[1-(4-imidazol-1-yl-3-nitrophenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[1-(4-imidazol-1-yl-3-nitro-phenyl)sulfonyl-4-piperidyl]methanone Formula: C22H23N5O5S2 MolecularWeight: 501.57852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCC3=C(C2)C=CS3)S(=O)(=O)C4=CC(=C(C=C4)N5C=CN=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)N2CCC3=C(C2)C=CS3)S(=O)(=O)C4=CC(=C(C=C4)N5C=CN=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O5S2/c28-22(24-8-5-21-17(14-24)6-12-33-21)16-3-9-26(10-4-16)34(31,32)18-1-2-19(20(13-18)27(29)30)25-11-7-23-15-25/h1-2,6-7,11-13,15-16H,3-5,8-10,14H2