N-(1,3-benzodioxol-5-ylmethyl)-5-(4-methylpiperazin-1-yl)sulfonyl-pyridin-2-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-methylpiperazin-1-yl)sulfonyl-pyridin-2-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-methylpiperazin-1-yl)sulfonyl-pyridin-2-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-amine Traditional Name: [5-(4-methylpiperazino)sulfonyl-2-pyridyl]-piperonyl-amine Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H22N4O4S/c1-21-6-8-22(9-7-21)27(23,24)15-3-5-18(20-12-15)19-11-14-2-4-16-17(10-14)26-13-25-16/h2-5,10,12H,6-9,11,13H2,1H3,(H,19,20)