(3Z)-3-[5-(4-methylpiperazin-1-yl)sulfonyl-1H-pyridin-2-ylidene]-2-oxidanylidene-1H-indole-5-carboxylic acid

Systemtic Name: (3Z)-3-[5-(4-methylpiperazin-1-yl)sulfonyl-1H-pyridin-2-ylidene]-2-oxidanylidene-1H-indole-5-carboxylic acid Openeye Name: (3Z)-3-[5-(4-methylpiperazin-1-yl)sulfonyl-1H-pyridin-2-ylidene]-2-oxo-indoline-5-carboxylic acid CAS Name: (3Z)-3-[5-[(4-methyl-1-piperazinyl)sulfonyl]-1H-pyridin-2-ylidene]-2-oxo-1H-indole-5-carboxylic acid IUPAC Name: (3Z)-3-[5-(4-methylpiperazin-1-yl)sulfonyl-1H-pyridin-2-ylidene]-2-oxo-1H-indole-5-carboxylic acid Traditional Name: (3Z)-2-keto-3-[5-(4-methylpiperazino)sulfonyl-1H-pyridin-2-ylidene]indoline-5-carboxylic acid Formula: C19H20N4O5S MolecularWeight: 416.4509

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CNC(=C3C4=C(C=CC(=C4)C(=O)O)NC3=O)C=C2

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CN/C(=C\3/C4=C(C=CC(=C4)C(=O)O)NC3=O)/C=C2

InChI

InChI=1S/C19H20N4O5S/c1-22-6-8-23(9-7-22)29(27,28)13-3-5-16(20-11-13)17-14-10-12(19(25)26)2-4-15(14)21-18(17)24/h2-5,10-11,20H,6-9H2,1H3,(H,21,24)(H,25,26)/b17-16-