(2S,3S)-2-azanyl-3-methyl-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pentan-1-one

Systemtic Name: (2S,3S)-2-azanyl-3-methyl-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pentan-1-one Openeye Name: (2S,3S)-2-amino-3-methyl-1-(4-thiazol-2-ylpiperazin-1-yl)pentan-1-one CAS Name: (2S,3S)-2-amino-3-methyl-1-[4-(2-thiazolyl)-1-piperazinyl]-1-pentanone IUPAC Name: (2S,3S)-2-amino-3-methyl-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pentan-1-one Traditional Name: (2S,3S)-2-amino-3-methyl-1-(4-thiazol-2-ylpiperazino)pentan-1-one Formula: C13H22N4OS MolecularWeight: 282.40498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C2=NC=CS2)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCN(CC1)C2=NC=CS2)N

InChI

InChI=1S/C13H22N4OS/c1-3-10(2)11(14)12(18)16-5-7-17(8-6-16)13-15-4-9-19-13/h4,9-11H,3,5-8,14H2,1-2H3/t10-,11-/m0/s1