N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(3-morpholin-4-ylpropyl)benzamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(3-morpholinopropyl)benzamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: 4-mesyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)benzamide Formula: C23H27N3O4S2 MolecularWeight: 473.60818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C23H27N3O4S2/c1-17-4-9-20-21(16-17)31-23(24-20)26(11-3-10-25-12-14-30-15-13-25)22(27)18-5-7-19(8-6-18)32(2,28)29/h4-9,16H,3,10-15H2,1-2H3