N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-5-piperidin-1-ylsulfonyl-pyridin-2-amine

Systemtic Name: N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-5-piperidin-1-ylsulfonyl-pyridin-2-amine Openeye Name: N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-5-(1-piperidylsulfonyl)pyridin-2-amine CAS Name: N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-5-(1-piperidinylsulfonyl)-2-pyridinamine IUPAC Name: N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-5-piperidin-1-ylsulfonylpyridin-2-amine Traditional Name: [(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-(5-piperidinosulfonyl-2-pyridyl)amine Formula: C18H19N5O6S MolecularWeight: 433.43836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)NN=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)N/N=C/C3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C18H19N5O6S/c24-23(25)15-9-17-16(28-12-29-17)8-13(15)10-20-21-18-5-4-14(11-19-18)30(26,27)22-6-2-1-3-7-22/h4-5,8-11H,1-3,6-7,12H2,(H,19,21)/b20-10+