2-[[5-[bis(azanyl)methylideneamino]-2-(1H-indol-5-ylamino)pentanoyl]-methyl-amino]ethanoate

Systemtic Name: 2-[[5-[bis(azanyl)methylideneamino]-2-(1H-indol-5-ylamino)pentanoyl]-methyl-amino]ethanoate Openeye Name: 2-[[5-guanidino-2-(1H-indol-5-ylamino)pentanoyl]-methyl-amino]acetate CAS Name: 2-[[5-(diaminomethylideneamino)-2-(1H-indol-5-ylamino)-1-oxopentyl]-methylamino]acetate IUPAC Name: 2-[[5-(diaminomethylideneamino)-2-(1H-indol-5-ylamino)pentanoyl]-methylamino]acetate Traditional Name: 2-[[5-guanidino-2-(1H-indol-5-ylamino)pentanoyl]-methyl-amino]acetate Formula: C17H23N6O3- MolecularWeight: 359.40292

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)[O-])C(=O)C(CCCN=C(N)N)NC1=CC2=C(C=C1)NC=C2

Isomeric SMILES

CN(CC(=O)[O-])C(=O)C(CCCN=C(N)N)NC1=CC2=C(C=C1)NC=C2

InChI

InChI=1S/C17H24N6O3/c1-23(10-15(24)25)16(26)14(3-2-7-21-17(18)19)22-12-4-5-13-11(9-12)6-8-20-13/h4-6,8-9,14,20,22H,2-3,7,10H2,1H3,(H,24,25)(H4,18,19,21)/p-1