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

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(2-morpholin-4-ylethyl)benzamide hydrochloride Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(2-morpholinoethyl)benzamide hydrochloride CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-[2-(4-morpholinyl)ethyl]benzamide hydrochloride IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(2-morpholin-4-ylethyl)benzamide hydrochloride Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-mesyl-N-(2-morpholinoethyl)benzamide hydrochloride Formula: C21H23Cl2N3O4S2 MolecularWeight: 516.46102

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N(CCN2CCOCC2)C3=NC4=C(S3)C=C(C=C4)Cl.Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N(CCN2CCOCC2)C3=NC4=C(S3)C=C(C=C4)Cl.Cl

InChI

InChI=1S/C21H22ClN3O4S2.ClH/c1-31(27,28)19-5-3-2-4-16(19)20(26)25(9-8-24-10-12-29-13-11-24)21-23-17-7-6-15(22)14-18(17)30-21;/h2-7,14H,8-13H2,1H3;1H