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2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(azocan-1-yl)ethanone

2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(azocan-1-yl)ethanone

Systemtic Name:2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(azocan-1-yl)ethanone
Openeye Name:2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(azocan-1-yl)ethanone
CAS Name:2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-1-(1-azocanyl)ethanone
IUPAC Name:2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(azocan-1-yl)ethanone
Traditional Name:2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-1-(azocan-1-yl)ethanone
Formula: C12H21N5OS
MolecularWeight: 283.39304
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SCC(=O)N2CCCCCCC2


Isomeric SMILES

CC1=NN=C(N1N)SCC(=O)N2CCCCCCC2


InChI

InChI=1S/C12H21N5OS/c1-10-14-15-12(17(10)13)19-9-11(18)16-7-5-3-2-4-6-8-16/h2-9,13H2,1H3


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