4-cyano-N-(2-dimethylaminoethyl)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-cyano-N-(2-dimethylaminoethyl)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-cyano-N-(2-dimethylaminoethyl)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-cyano-N-(2-dimethylaminoethyl)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-cyano-N-(2-dimethylaminoethyl)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-cyano-N-(2-dimethylaminoethyl)-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)benzamide Formula: C21H22N4OS MolecularWeight: 378.49058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N(CCN(C)C)C(=O)C3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N(CCN(C)C)C(=O)C3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C21H22N4OS/c1-14-5-10-18-19(15(14)2)23-21(27-18)25(12-11-24(3)4)20(26)17-8-6-16(13-22)7-9-17/h5-10H,11-12H2,1-4H3