3-(1,3-benzothiazol-2-ylsulfanyl)-N-cycloheptyl-propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-cycloheptyl-propanamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-cycloheptyl-propanamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-cycloheptylpropanamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-cycloheptylpropanamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-cycloheptyl-propionamide Formula: C17H22N2OS2 MolecularWeight: 334.49938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CCCC(CC1)NC(=O)CCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H22N2OS2/c20-16(18-13-7-3-1-2-4-8-13)11-12-21-17-19-14-9-5-6-10-15(14)22-17/h5-6,9-10,13H,1-4,7-8,11-12H2,(H,18,20)