3-[2-[5-[bis(azanyl)methylideneamino]pentanoyl-pyrrolidin-2-ylcarbonyl-amino]pyridin-3-yl]propanoate

Systemtic Name: 3-[2-[5-[bis(azanyl)methylideneamino]pentanoyl-pyrrolidin-2-ylcarbonyl-amino]pyridin-3-yl]propanoate Openeye Name: 3-[2-[5-guanidinopentanoyl(pyrrolidine-2-carbonyl)amino]-3-pyridyl]propanoate CAS Name: 3-[2-[[5-(diaminomethylideneamino)-1-oxopentyl]-[oxo(2-pyrrolidinyl)methyl]amino]-3-pyridinyl]propanoate IUPAC Name: 3-[2-[5-(diaminomethylideneamino)pentanoyl-(pyrrolidine-2-carbonyl)amino]pyridin-3-yl]propanoate Traditional Name: 3-[2-[5-guanidinopentanoyl(prolyl)amino]-3-pyridyl]propionate Formula: C19H27N6O4- MolecularWeight: 403.45548

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)N(C2=C(C=CC=N2)CCC(=O)[O-])C(=O)CCCCN=C(N)N

Isomeric SMILES

C1CC(NC1)C(=O)N(C2=C(C=CC=N2)CCC(=O)[O-])C(=O)CCCCN=C(N)N

InChI

InChI=1S/C19H28N6O4/c20-19(21)24-10-2-1-7-15(26)25(18(29)14-6-4-11-22-14)17-13(5-3-12-23-17)8-9-16(27)28/h3,5,12,14,22H,1-2,4,6-11H2,(H,27,28)(H4,20,21,24)/p-1