(2R)-5-(aminocarbonylamino)-2-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonylamino]pentanoate

Systemtic Name: (2R)-5-(aminocarbonylamino)-2-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonylamino]pentanoate Openeye Name: (2R)-2-[(2,4-dimethylthiazole-5-carbonyl)amino]-5-ureido-pentanoate CAS Name: (2R)-5-(carbamoylamino)-2-[[(2,4-dimethyl-5-thiazolyl)-oxomethyl]amino]pentanoate IUPAC Name: (2R)-5-(carbamoylamino)-2-[(2,4-dimethyl-1,3-thiazole-5-carbonyl)amino]pentanoate Traditional Name: (2R)-2-[(2,4-dimethylthiazole-5-carbonyl)amino]-5-ureido-valerate Formula: C12H17N4O4S- MolecularWeight: 313.35278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)C(=O)NC(CCCNC(=O)N)C(=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C)C(=O)N[C@H](CCCNC(=O)N)C(=O)[O-]

InChI

InChI=1S/C12H18N4O4S/c1-6-9(21-7(2)15-6)10(17)16-8(11(18)19)4-3-5-14-12(13)20/h8H,3-5H2,1-2H3,(H,16,17)(H,18,19)(H3,13,14,20)/p-1/t8-/m1/s1