(Z)-3-methyl-5-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]pent-2-enenitrile

Systemtic Name: (Z)-3-methyl-5-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]pent-2-enenitrile Openeye Name: (Z)-3-methyl-5-(1,1,3-trioxo-1,2-benzothiazol-2-yl)pent-2-enenitrile CAS Name: (Z)-3-methyl-5-(1,1,3-trioxo-1,2-benzothiazol-2-yl)-2-pentenenitrile IUPAC Name: (Z)-3-methyl-5-(1,1,3-trioxo-1,2-benzothiazol-2-yl)pent-2-enenitrile Traditional Name: (Z)-3-methyl-5-(1,1,3-triketo-1,2-benzothiazol-2-yl)pent-2-enenitrile Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC#N)CCN1C(=O)C2=CC=CC=C2S1(=O)=O

Isomeric SMILES

C/C(=C/C#N)/CCN1C(=O)C2=CC=CC=C2S1(=O)=O

InChI

InChI=1S/C13H12N2O3S/c1-10(6-8-14)7-9-15-13(16)11-4-2-3-5-12(11)19(15,17)18/h2-6H,7,9H2,1H3/b10-6-