2-azanyl-2-[3-[bis(azanyl)methylideneamino]propyl]-3-oxidanylidene-5-phenyl-4-(pyrrolidin-2-ylcarbonylamino)pentanoic acid

Systemtic Name: 2-azanyl-2-[3-[bis(azanyl)methylideneamino]propyl]-3-oxidanylidene-5-phenyl-4-(pyrrolidin-2-ylcarbonylamino)pentanoic acid Openeye Name: 2-amino-2-(3-guanidinopropyl)-3-oxo-5-phenyl-4-(pyrrolidine-2-carbonylamino)pentanoic acid CAS Name: 2-amino-2-[3-(diaminomethylideneamino)propyl]-3-oxo-4-[[oxo(2-pyrrolidinyl)methyl]amino]-5-phenylpentanoic acid IUPAC Name: 2-amino-2-[3-(diaminomethylideneamino)propyl]-3-oxo-5-phenyl-4-(pyrrolidine-2-carbonylamino)pentanoic acid Traditional Name: 2-amino-2-(3-guanidinopropyl)-3-keto-5-phenyl-4-(prolylamino)valeric acid Formula: C20H30N6O4 MolecularWeight: 418.49

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)NC(CC2=CC=CC=C2)C(=O)C(CCCN=C(N)N)(C(=O)O)N

Isomeric SMILES

C1CC(NC1)C(=O)NC(CC2=CC=CC=C2)C(=O)C(CCCN=C(N)N)(C(=O)O)N

InChI

InChI=1S/C20H30N6O4/c21-19(22)25-11-5-9-20(23,18(29)30)16(27)15(12-13-6-2-1-3-7-13)26-17(28)14-8-4-10-24-14/h1-3,6-7,14-15,24H,4-5,8-12,23H2,(H,26,28)(H,29,30)(H4,21,22,25)