N-[[5-[3-[(4-morpholin-4-ylsulfonylphenyl)amino]piperidin-1-yl]sulfonylthiophen-2-yl]methyl]-3-nitro-benzamide

Systemtic Name: N-[[5-[3-[(4-morpholin-4-ylsulfonylphenyl)amino]piperidin-1-yl]sulfonylthiophen-2-yl]methyl]-3-nitro-benzamide Openeye Name: N-[[5-[[3-(4-morpholinosulfonylanilino)-1-piperidyl]sulfonyl]-2-thienyl]methyl]-3-nitro-benzamide CAS Name: N-[[5-[[3-[4-(4-morpholinylsulfonyl)anilino]-1-piperidinyl]sulfonyl]-2-thiophenyl]methyl]-3-nitrobenzamide IUPAC Name: N-[[5-[3-(4-morpholin-4-ylsulfonylanilino)piperidin-1-yl]sulfonylthiophen-2-yl]methyl]-3-nitrobenzamide Traditional Name: N-[[5-[3-(4-morpholinosulfonylanilino)piperidino]sulfonyl-2-thienyl]methyl]-3-nitro-benzamide Formula: C27H31N5O8S3 MolecularWeight: 649.75874

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])NC4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])NC4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C27H31N5O8S3/c33-27(20-3-1-5-23(17-20)32(34)35)28-18-24-8-11-26(41-24)43(38,39)31-12-2-4-22(19-31)29-21-6-9-25(10-7-21)42(36,37)30-13-15-40-16-14-30/h1,3,5-11,17,22,29H,2,4,12-16,18-19H2,(H,28,33)