3-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]azepan-2-one

Systemtic Name: 3-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]azepan-2-one Openeye Name: 3-(4-methylthiazol-2-yl)sulfanylazepan-2-one CAS Name: 3-[(4-methyl-2-thiazolyl)thio]-2-azepanone IUPAC Name: 3-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]azepan-2-one Traditional Name: 3-[(4-methylthiazol-2-yl)thio]azepan-2-one Formula: C10H14N2OS2 MolecularWeight: 242.36096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2CCCCNC2=O

Isomeric SMILES

CC1=CSC(=N1)SC2CCCCNC2=O

InChI

InChI=1S/C10H14N2OS2/c1-7-6-14-10(12-7)15-8-4-2-3-5-11-9(8)13/h6,8H,2-5H2,1H3,(H,11,13)