2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[(1-morpholinocyclohexyl)methyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[[1-(4-morpholinyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[(1-morpholinocyclohexyl)methyl]acetamide Formula: C21H29N3O2S2 MolecularWeight: 419.60386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CSCC2=NC3=CC=CC=C3S2)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CSCC2=NC3=CC=CC=C3S2)N4CCOCC4

InChI

InChI=1S/C21H29N3O2S2/c25-19(14-27-15-20-23-17-6-2-3-7-18(17)28-20)22-16-21(8-4-1-5-9-21)24-10-12-26-13-11-24/h2-3,6-7H,1,4-5,8-16H2,(H,22,25)