3,3-dimethyl-4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]piperazin-2-one

Systemtic Name: 3,3-dimethyl-4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]piperazin-2-one Openeye Name: 3,3-dimethyl-4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]piperazin-2-one CAS Name: 3,3-dimethyl-4-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-2-piperazinone IUPAC Name: 3,3-dimethyl-4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]piperazin-2-one Traditional Name: 3,3-dimethyl-4-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]piperazin-2-one Formula: C11H17N5O2S MolecularWeight: 283.34998

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NCCN1C(=O)CSC2=NN=CN2C)C

Isomeric SMILES

CC1(C(=O)NCCN1C(=O)CSC2=NN=CN2C)C

InChI

InChI=1S/C11H17N5O2S/c1-11(2)9(18)12-4-5-16(11)8(17)6-19-10-14-13-7-15(10)3/h7H,4-6H2,1-3H3,(H,12,18)