2-[2-[[6-azanyl-5-[bis(azanyl)methylidenecarbamoyl]-3-chloranyl-pyrazin-2-yl]amino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[[6-azanyl-5-[bis(azanyl)methylidenecarbamoyl]-3-chloranyl-pyrazin-2-yl]amino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[[6-amino-3-chloro-5-(diaminomethylenecarbamoyl)pyrazin-2-yl]amino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[6-amino-3-chloro-5-[(diaminomethylideneamino)-oxomethyl]-2-pyrazinyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[[6-amino-3-chloro-5-(diaminomethylidenecarbamoyl)pyrazin-2-yl]amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[[6-amino-3-chloro-5-(diaminomethylenecarbamoyl)pyrazin-2-yl]amino]acetyl]amino]acetic acid Formula: C10H13ClN8O4 MolecularWeight: 344.71442

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)NCC(=O)O)NC1=NC(=C(N=C1Cl)C(=O)N=C(N)N)N

Isomeric SMILES

C(C(=O)NCC(=O)O)NC1=NC(=C(N=C1Cl)C(=O)N=C(N)N)N

InChI

InChI=1S/C10H13ClN8O4/c11-6-8(16-1-3(20)15-2-4(21)22)18-7(12)5(17-6)9(23)19-10(13)14/h1-2H2,(H,15,20)(H,21,22)(H3,12,16,18)(H4,13,14,19,23)