2-[4-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(3-oxo-4H-1,4-benzothiazine-6-carbonyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[oxo-(3-oxo-4H-1,4-benzothiazin-6-yl)methyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(3-oxo-4H-1,4-benzothiazine-6-carbonyl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(3-keto-4H-1,4-benzothiazine-6-carbonyl)piperazino]isonicotinonitrile Formula: C19H17N5O2S MolecularWeight: 379.43558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C19H17N5O2S/c20-11-13-3-4-21-17(9-13)23-5-7-24(8-6-23)19(26)14-1-2-16-15(10-14)22-18(25)12-27-16/h1-4,9-10H,5-8,12H2,(H,22,25)