2-[bis(azanyl)methylideneamino]-1,3-thiazole-4-carboxylic acid; hexane

Systemtic Name: 2-[bis(azanyl)methylideneamino]-1,3-thiazole-4-carboxylic acid; hexane Openeye Name: 2-guanidinothiazole-4-carboxylic acid; hexane CAS Name: 2-(diaminomethylideneamino)-4-thiazolecarboxylic acid; hexane IUPAC Name: 2-(diaminomethylideneamino)-1,3-thiazole-4-carboxylic acid; hexane Traditional Name: 2-guanidinothiazole-4-carboxylic acid; n-hexane Formula: C11H20N4O2S MolecularWeight: 272.3671

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC.C1=C(N=C(S1)N=C(N)N)C(=O)O

Isomeric SMILES

CCCCCC.C1=C(N=C(S1)N=C(N)N)C(=O)O

InChI

InChI=1S/C6H14.C5H6N4O2S/c1-3-5-6-4-2;6-4(7)9-5-8-2(1-12-5)3(10)11/h3-6H2,1-2H3;1H,(H,10,11)(H4,6,7,8,9)