N-[5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]-N-(3,4-dihydro-1H-isochromen-3-ylcarbonyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]-N-(3,4-dihydro-1H-isochromen-3-ylcarbonyl)pyrrolidine-2-carboxamide Openeye Name: N-(1-formyl-4-guanidino-butyl)-N-(isochromane-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-N-[3,4-dihydro-1H-2-benzopyran-3-yl(oxo)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-N-(3,4-dihydro-1H-isochromene-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(1-formyl-4-guanidino-butyl)-N-(isochroman-3-carbonyl)pyrrolidine-2-carboxamide Formula: C21H29N5O4 MolecularWeight: 415.48606

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)N(C(CCCN=C(N)N)C=O)C(=O)C2CC3=CC=CC=C3CO2

Isomeric SMILES

C1CC(NC1)C(=O)N(C(CCCN=C(N)N)C=O)C(=O)C2CC3=CC=CC=C3CO2

InChI

InChI=1S/C21H29N5O4/c22-21(23)25-10-3-7-16(12-27)26(19(28)17-8-4-9-24-17)20(29)18-11-14-5-1-2-6-15(14)13-30-18/h1-2,5-6,12,16-18,24H,3-4,7-11,13H2,(H4,22,23,25)