3-[(2S)-2-methylpiperidin-1-yl]-6-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyridazine

Systemtic Name: 3-[(2S)-2-methylpiperidin-1-yl]-6-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyridazine Openeye Name: 3-[(2S)-2-methyl-1-piperidyl]-6-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyridazine CAS Name: 3-[(2S)-2-methyl-1-piperidinyl]-6-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]pyridazine IUPAC Name: 3-[(2S)-2-methylpiperidin-1-yl]-6-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyridazine Traditional Name: 3-[(2S)-2-methylpiperidino]-6-(4-nosylpiperazino)pyridazine Formula: C20H26N6O4S MolecularWeight: 446.52324

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCCN1C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H26N6O4S/c1-16-4-2-3-11-25(16)20-10-9-19(21-22-20)23-12-14-24(15-13-23)31(29,30)18-7-5-17(6-8-18)26(27)28/h5-10,16H,2-4,11-15H2,1H3/t16-/m0/s1