2-[4-azanyl-5-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)pyrrolidin-1-yl]-5-oxidanylidene-pentyl]guanidine

Systemtic Name: 2-[4-azanyl-5-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)pyrrolidin-1-yl]-5-oxidanylidene-pentyl]guanidine Openeye Name: 2-[4-amino-5-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)pyrrolidin-1-yl]-5-oxo-pentyl]guanidine CAS Name: 2-[4-amino-5-[2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-pyrrolidinyl]-5-oxopentyl]guanidine IUPAC Name: 2-[4-amino-5-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)pyrrolidin-1-yl]-5-oxopentyl]guanidine Traditional Name: 2-[4-amino-5-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)pyrrolidino]-5-keto-pentyl]guanidine Formula: C20H30N6O2 MolecularWeight: 386.4912

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CCCN=C(N)N)N)C(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

C1CC(N(C1)C(=O)C(CCCN=C(N)N)N)C(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H30N6O2/c21-16(7-3-10-24-20(22)23)18(27)26-11-4-8-17(26)19(28)25-12-9-14-5-1-2-6-15(14)13-25/h1-2,5-6,16-17H,3-4,7-13,21H2,(H4,22,23,24)