N-(6-chloranyl-1,3-benzothiazol-2-yl)-4-cyano-N-(2-diethylaminoethyl)benzamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-4-cyano-N-(2-diethylaminoethyl)benzamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-(2-diethylaminoethyl)benzamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-(2-diethylaminoethyl)benzamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-(2-diethylaminoethyl)benzamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-(2-diethylaminoethyl)benzamide Formula: C21H21ClN4OS MolecularWeight: 412.93564

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)Cl)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)Cl)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H21ClN4OS/c1-3-25(4-2)11-12-26(20(27)16-7-5-15(14-23)6-8-16)21-24-18-10-9-17(22)13-19(18)28-21/h5-10,13H,3-4,11-12H2,1-2H3