(3S)-3-[4-[(1S)-1-azanyl-2-methyl-propyl]-1,2,3-triazol-1-yl]-4-oxidanylidene-4-piperazin-1-yl-butanamide

Systemtic Name: (3S)-3-[4-[(1S)-1-azanyl-2-methyl-propyl]-1,2,3-triazol-1-yl]-4-oxidanylidene-4-piperazin-1-yl-butanamide Openeye Name: (3S)-3-[4-[(1S)-1-amino-2-methyl-propyl]triazol-1-yl]-4-oxo-4-piperazin-1-yl-butanamide CAS Name: (3S)-3-[4-[(1S)-1-amino-2-methylpropyl]-1-triazolyl]-4-oxo-4-(1-piperazinyl)butanamide IUPAC Name: (3S)-3-[4-[(1S)-1-amino-2-methylpropyl]triazol-1-yl]-4-oxo-4-piperazin-1-ylbutanamide Traditional Name: (3S)-3-[4-[(1S)-1-amino-2-methyl-propyl]triazol-1-yl]-4-keto-4-piperazino-butyramide Formula: C14H25N7O2 MolecularWeight: 323.394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H25N7O2/c1-9(2)13(16)10-8-21(19-18-10)11(7-12(15)22)14(23)20-5-3-17-4-6-20/h8-9,11,13,17H,3-7,16H2,1-2H3,(H2,15,22)/t11-,13-/m0/s1