(2Z)-3-oxidanylidene-2-[oxidanyl-[propan-2-yl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methylidene]-4-thiophen-2-yl-butanenitrile

Systemtic Name: (2Z)-3-oxidanylidene-2-[oxidanyl-[propan-2-yl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methylidene]-4-thiophen-2-yl-butanenitrile Openeye Name: (2Z)-2-[hydroxy-[isopropyl-(2-thioxo-3H-1,3-benzothiazol-6-yl)amino]methylene]-3-oxo-4-(2-thienyl)butanenitrile CAS Name: (2Z)-2-[hydroxy-[propan-2-yl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methylidene]-3-oxo-4-thiophen-2-ylbutanenitrile IUPAC Name: (2Z)-2-[hydroxy-[propan-2-yl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methylidene]-3-oxo-4-thiophen-2-ylbutanenitrile Traditional Name: (Z)-3-hydroxy-3-[isopropyl-(2-thioxo-3H-1,3-benzothiazol-6-yl)amino]-2-[2-(2-thienyl)acetyl]acrylonitrile Formula: C19H17N3O2S3 MolecularWeight: 415.55218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC2=C(C=C1)NC(=S)S2)C(=C(C#N)C(=O)CC3=CC=CS3)O

Isomeric SMILES

CC(C)N(C1=CC2=C(C=C1)NC(=S)S2)/C(=C(\C#N)/C(=O)CC3=CC=CS3)/O

InChI

InChI=1S/C19H17N3O2S3/c1-11(2)22(12-5-6-15-17(8-12)27-19(25)21-15)18(24)14(10-20)16(23)9-13-4-3-7-26-13/h3-8,11,24H,9H2,1-2H3,(H,21,25)/b18-14-