1-(2-azanyl-3,3-dimethyl-butanoyl)-2-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbaldehyde

Systemtic Name: 1-(2-azanyl-3,3-dimethyl-butanoyl)-2-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbaldehyde Openeye Name: 1-(2-amino-3,3-dimethyl-butanoyl)-2-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbaldehyde CAS Name: 1-(2-amino-3,3-dimethyl-1-oxobutyl)-2-[2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]-3,4-dihydro-1H-isoquinoline-3-carboxaldehyde IUPAC Name: 1-(2-amino-3,3-dimethylbutanoyl)-2-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbaldehyde Traditional Name: 1-(2-amino-3,3-dimethyl-butanoyl)-2-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbaldehyde Formula: C22H29N5O3 MolecularWeight: 411.49736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)C1C2=CC=CC=C2CC(N1C(=O)C(CC3=CN=CN3)N)C=O)N

Isomeric SMILES

CC(C)(C)C(C(=O)C1C2=CC=CC=C2CC(N1C(=O)C(CC3=CN=CN3)N)C=O)N

InChI

InChI=1S/C22H29N5O3/c1-22(2,3)20(24)19(29)18-16-7-5-4-6-13(16)8-15(11-28)27(18)21(30)17(23)9-14-10-25-12-26-14/h4-7,10-12,15,17-18,20H,8-9,23-24H2,1-3H3,(H,25,26)