N-(6-chloranyl-1,3-benzothiazol-2-yl)-4-cyano-N-(2-morpholin-4-ylethyl)benzamide hydrochloride

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-4-cyano-N-(2-morpholin-4-ylethyl)benzamide hydrochloride Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-(2-morpholinoethyl)benzamide hydrochloride CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-[2-(4-morpholinyl)ethyl]benzamide hydrochloride IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-(2-morpholin-4-ylethyl)benzamide hydrochloride Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-cyano-N-(2-morpholinoethyl)benzamide hydrochloride Formula: C21H20Cl2N4O2S MolecularWeight: 463.3801

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN(C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)C#N.Cl

Isomeric SMILES

C1COCCN1CCN(C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)C#N.Cl

InChI

InChI=1S/C21H19ClN4O2S.ClH/c22-17-5-6-18-19(13-17)29-21(24-18)26(8-7-25-9-11-28-12-10-25)20(27)16-3-1-15(14-23)2-4-16;/h1-6,13H,7-12H2;1H