N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-2-oxidanylidene-3H-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-2-oxidanylidene-3H-1,3-benzoxazole-6-sulfonamide Openeye Name: N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide CAS Name: N-[6-(4-methyl-1-piperazinyl)-3-pyridinyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide Traditional Name: 2-keto-N-[6-(4-methylpiperazino)-3-pyridyl]-3H-1,3-benzoxazole-6-sulfonamide Formula: C17H19N5O4S MolecularWeight: 389.42886

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)O4

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)O4

InChI

InChI=1S/C17H19N5O4S/c1-21-6-8-22(9-7-21)16-5-2-12(11-18-16)20-27(24,25)13-3-4-14-15(10-13)26-17(23)19-14/h2-5,10-11,20H,6-9H2,1H3,(H,19,23)