2-(benzenecarbonothioylamino)-5-[bis(azanyl)methylideneamino]pentanoic acid

Systemtic Name: 2-(benzenecarbonothioylamino)-5-[bis(azanyl)methylideneamino]pentanoic acid Openeye Name: 2-(benzenecarbonothioylamino)-5-guanidino-pentanoic acid CAS Name: 2-(benzenecarbonothioylamino)-5-(diaminomethylideneamino)pentanoic acid IUPAC Name: 2-(benzenecarbonothioylamino)-5-(diaminomethylideneamino)pentanoic acid Traditional Name: 2-(benzenecarbonothioylamino)-5-guanidino-valeric acid Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=S)NC(CCCN=C(N)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=S)NC(CCCN=C(N)N)C(=O)O

InChI

InChI=1S/C13H18N4O2S/c14-13(15)16-8-4-7-10(12(18)19)17-11(20)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2,(H,17,20)(H,18,19)(H4,14,15,16)