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

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-methylsulfanyl-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-methylsulfanyl-N-(3-morpholinopropyl)benzamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-(methylthio)-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-methylsulfanyl-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-(methylthio)-N-(3-morpholinopropyl)benzamide Formula: C23H27N3O2S2 MolecularWeight: 441.60938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O2S2/c1-17-7-8-20-21(15-17)30-23(24-20)26(10-4-9-25-11-13-28-14-12-25)22(27)18-5-3-6-19(16-18)29-2/h3,5-8,15-16H,4,9-14H2,1-2H3