N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(3-morpholin-4-ylpropyl)benzamide

Systemtic Name: N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(3-morpholinopropyl)benzamide CAS Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-2-mesyl-N-(3-morpholinopropyl)benzamide Formula: C23H26ClN3O4S2 MolecularWeight: 508.05324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CCCN3CCOCC3)C(=O)C4=CC=CC=C4S(=O)(=O)C

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CCCN3CCOCC3)C(=O)C4=CC=CC=C4S(=O)(=O)C

InChI

InChI=1S/C23H26ClN3O4S2/c1-16-8-9-18(24)21-20(16)25-23(32-21)27(11-5-10-26-12-14-31-15-13-26)22(28)17-6-3-4-7-19(17)33(2,29)30/h3-4,6-9H,5,10-15H2,1-2H3