(2S)-2-(2-azanylethanoylamino)-N-[(3S)-7-azanyl-2-oxidanylidene-heptan-3-yl]-3-(1H-imidazol-5-yl)propanamide

Systemtic Name: (2S)-2-(2-azanylethanoylamino)-N-[(3S)-7-azanyl-2-oxidanylidene-heptan-3-yl]-3-(1H-imidazol-5-yl)propanamide Openeye Name: (2S)-N-[(1S)-1-acetyl-5-amino-pentyl]-2-[(2-aminoacetyl)amino]-3-(1H-imidazol-5-yl)propanamide CAS Name: (2S)-2-[(2-amino-1-oxoethyl)amino]-N-[(3S)-7-amino-2-oxoheptan-3-yl]-3-(1H-imidazol-5-yl)propanamide IUPAC Name: (2S)-2-[(2-aminoacetyl)amino]-N-[(3S)-7-amino-2-oxoheptan-3-yl]-3-(1H-imidazol-5-yl)propanamide Traditional Name: (2S)-N-[(1S)-1-acetyl-5-amino-pentyl]-2-(glycylamino)-3-(1H-imidazol-5-yl)propionamide Formula: C15H26N6O3 MolecularWeight: 338.40534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCCN)NC(=O)C(CC1=CN=CN1)NC(=O)CN

Isomeric SMILES

CC(=O)[C@H](CCCCN)NC(=O)[C@H](CC1=CN=CN1)NC(=O)CN

InChI

InChI=1S/C15H26N6O3/c1-10(22)12(4-2-3-5-16)21-15(24)13(20-14(23)7-17)6-11-8-18-9-19-11/h8-9,12-13H,2-7,16-17H2,1H3,(H,18,19)(H,20,23)(H,21,24)/t12-,13-/m0/s1