5-[(2Z)-2-[1,3-benzothiazol-2-yl(cyano)methylidene]hydrazinyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[(2Z)-2-[1,3-benzothiazol-2-yl(cyano)methylidene]hydrazinyl]benzene-1,3-dicarboxylic acid Openeye Name: 5-[(2Z)-2-[1,3-benzothiazol-2-yl(cyano)methylene]hydrazino]benzene-1,3-dicarboxylic acid CAS Name: 5-[(2Z)-2-[1,3-benzothiazol-2-yl(cyano)methylidene]hydrazinyl]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[(2Z)-2-[1,3-benzothiazol-2-yl(cyano)methylidene]hydrazinyl]benzene-1,3-dicarboxylic acid Traditional Name: 5-[(N'Z)-N'-[1,3-benzothiazol-2-yl(cyano)methylene]hydrazino]isophthalic acid Formula: C17H10N4O4S MolecularWeight: 366.3507

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=NNC3=CC(=CC(=C3)C(=O)O)C(=O)O)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C(=N\NC3=CC(=CC(=C3)C(=O)O)C(=O)O)/C#N

InChI

InChI=1S/C17H10N4O4S/c18-8-13(15-19-12-3-1-2-4-14(12)26-15)21-20-11-6-9(16(22)23)5-10(7-11)17(24)25/h1-7,20H,(H,22,23)(H,24,25)/b21-13-