1-(azepan-1-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)ethanone Openeye Name: 1-(azepan-1-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)ethanone CAS Name: 1-(1-azepanyl)-2-(1,3-benzothiazol-2-ylthio)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)ethanone Traditional Name: 1-(azepan-1-yl)-2-(1,3-benzothiazol-2-ylthio)ethanone Formula: C15H18N2OS2 MolecularWeight: 306.44622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H18N2OS2/c18-14(17-9-5-1-2-6-10-17)11-19-15-16-12-7-3-4-8-13(12)20-15/h3-4,7-8H,1-2,5-6,9-11H2