(2S)-6-azanyl-2-[4-[(1S)-1-azanyl-3-methyl-butyl]-1,2,3-triazol-1-yl]-1-piperazin-1-yl-hexan-1-one

Systemtic Name: (2S)-6-azanyl-2-[4-[(1S)-1-azanyl-3-methyl-butyl]-1,2,3-triazol-1-yl]-1-piperazin-1-yl-hexan-1-one Openeye Name: (2S)-6-amino-2-[4-[(1S)-1-amino-3-methyl-butyl]triazol-1-yl]-1-piperazin-1-yl-hexan-1-one CAS Name: (2S)-6-amino-2-[4-[(1S)-1-amino-3-methylbutyl]-1-triazolyl]-1-(1-piperazinyl)-1-hexanone IUPAC Name: (2S)-6-amino-2-[4-[(1S)-1-amino-3-methylbutyl]triazol-1-yl]-1-piperazin-1-ylhexan-1-one Traditional Name: (2S)-6-amino-2-[4-[(1S)-1-amino-3-methyl-butyl]triazol-1-yl]-1-piperazino-hexan-1-one Formula: C17H33N7O MolecularWeight: 351.49022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CN(N=N1)C(CCCCN)C(=O)N2CCNCC2)N

Isomeric SMILES

CC(C)C[C@@H](C1=CN(N=N1)[C@@H](CCCCN)C(=O)N2CCNCC2)N

InChI

InChI=1S/C17H33N7O/c1-13(2)11-14(19)15-12-24(22-21-15)16(5-3-4-6-18)17(25)23-9-7-20-8-10-23/h12-14,16,20H,3-11,18-19H2,1-2H3/t14-,16-/m0/s1