2-[(3S)-4-[2-acetamido-3-(1H-imidazol-5-yl)propanoyl]-3-methyl-2-oxidanylidene-piperazin-1-yl]-3-methyl-butanamide

Systemtic Name: 2-[(3S)-4-[2-acetamido-3-(1H-imidazol-5-yl)propanoyl]-3-methyl-2-oxidanylidene-piperazin-1-yl]-3-methyl-butanamide Openeye Name: 2-[(3S)-4-[2-acetamido-3-(1H-imidazol-5-yl)propanoyl]-3-methyl-2-oxo-piperazin-1-yl]-3-methyl-butanamide CAS Name: 2-[(3S)-4-[2-acetamido-3-(1H-imidazol-5-yl)-1-oxopropyl]-3-methyl-2-oxo-1-piperazinyl]-3-methylbutanamide IUPAC Name: 2-[(3S)-4-[2-acetamido-3-(1H-imidazol-5-yl)propanoyl]-3-methyl-2-oxopiperazin-1-yl]-3-methylbutanamide Traditional Name: 2-[(3S)-4-[2-acetamido-3-(1H-imidazol-5-yl)propanoyl]-2-keto-3-methyl-piperazino]-3-methyl-butyramide Formula: C18H28N6O4 MolecularWeight: 392.45272

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CCN1C(=O)C(CC2=CN=CN2)NC(=O)C)C(C(C)C)C(=O)N

Isomeric SMILES

C[C@H]1C(=O)N(CCN1C(=O)C(CC2=CN=CN2)NC(=O)C)C(C(C)C)C(=O)N

InChI

InChI=1S/C18H28N6O4/c1-10(2)15(16(19)26)24-6-5-23(11(3)17(24)27)18(28)14(22-12(4)25)7-13-8-20-9-21-13/h8-11,14-15H,5-7H2,1-4H3,(H2,19,26)(H,20,21)(H,22,25)/t11-,14?,15?/m0/s1