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

Systemtic Name: N-[5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]-N-(3,4-dihydro-1H-isochromen-1-ylcarbonyl)pyrrolidine-2-carboxamide Openeye Name: N-(1-formyl-4-guanidino-butyl)-N-(isochromane-1-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-N-[3,4-dihydro-1H-2-benzopyran-1-yl(oxo)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-N-(3,4-dihydro-1H-isochromene-1-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(1-formyl-4-guanidino-butyl)-N-(isochroman-1-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)C2C3=CC=CC=C3CCO2

Isomeric SMILES

C1CC(NC1)C(=O)N(C(CCCN=C(N)N)C=O)C(=O)C2C3=CC=CC=C3CCO2

InChI

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