4-cyano-N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-cyano-N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-cyano-N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-cyano-N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-cyano-N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-cyano-N-(2-dimethylaminoethyl)-N-(4-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C20H20N4O3S2 MolecularWeight: 428.5278

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CN(C)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H20N4O3S2/c1-23(2)11-12-24(19(25)15-9-7-14(13-21)8-10-15)20-22-18-16(28-20)5-4-6-17(18)29(3,26)27/h4-10H,11-12H2,1-3H3