4-[(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-2-cyano-ethanoyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-[(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-2-cyano-ethanoyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-2-cyano-acetyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-2-cyano-1-oxoethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-2-cyanoacetyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-2-cyano-acetyl]-N,N-dimethyl-benzenesulfonamide Formula: C18H15N3O3S2 MolecularWeight: 385.46

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)C(=C2NC3=CC=CC=C3S2)C#N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)/C(=C/2\NC3=CC=CC=C3S2)/C#N

InChI

InChI=1S/C18H15N3O3S2/c1-21(2)26(23,24)13-9-7-12(8-10-13)17(22)14(11-19)18-20-15-5-3-4-6-16(15)25-18/h3-10,20H,1-2H3/b18-14+