2-[[3,5-bis(azanyl)-6-chloranyl-pyrazin-2-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: 2-[[3,5-bis(azanyl)-6-chloranyl-pyrazin-2-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: 2-[(3,5-diamino-6-chloro-pyrazine-2-carbonyl)amino]-3-phenyl-propanoate CAS Name: 2-[[(3,5-diamino-6-chloro-2-pyrazinyl)-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: 2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-3-phenylpropanoate Traditional Name: 2-[(3,5-diamino-6-chloro-pyrazinoyl)amino]-3-phenyl-propionate Formula: C14H13ClN5O3- MolecularWeight: 334.73772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=O)C2=C(N=C(C(=N2)Cl)N)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=O)C2=C(N=C(C(=N2)Cl)N)N

InChI

InChI=1S/C14H14ClN5O3/c15-10-12(17)20-11(16)9(19-10)13(21)18-8(14(22)23)6-7-4-2-1-3-5-7/h1-5,8H,6H2,(H,18,21)(H,22,23)(H4,16,17,20)/p-1