4-(1,3-benzothiazol-2-ylsulfanyl)-N-cycloheptyl-butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-cycloheptyl-butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-cycloheptyl-butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-cycloheptylbutanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-cycloheptylbutanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-cycloheptyl-butyramide Formula: C18H24N2OS2 MolecularWeight: 348.52596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CCCC(CC1)NC(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H24N2OS2/c21-17(19-14-8-3-1-2-4-9-14)12-7-13-22-18-20-15-10-5-6-11-16(15)23-18/h5-6,10-11,14H,1-4,7-9,12-13H2,(H,19,21)