1-[2-(1H-imidazol-2-ylmethylamino)-3,3-dimethyl-butanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde

Systemtic Name: 1-[2-(1H-imidazol-2-ylmethylamino)-3,3-dimethyl-butanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Openeye Name: 1-[2-(1H-imidazol-2-ylmethylamino)-3,3-dimethyl-butanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde CAS Name: 1-[2-(1H-imidazol-2-ylmethylamino)-3,3-dimethyl-1-oxobutyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxaldehyde IUPAC Name: 1-[2-(1H-imidazol-2-ylmethylamino)-3,3-dimethylbutanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Traditional Name: 1-[2-(1H-imidazol-2-ylmethylamino)-3,3-dimethyl-butanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)C1C2=CC=CC=C2CC(N1)C=O)NCC3=NC=CN3

Isomeric SMILES

CC(C)(C)C(C(=O)C1C2=CC=CC=C2CC(N1)C=O)NCC3=NC=CN3

InChI

InChI=1S/C20H26N4O2/c1-20(2,3)19(23-11-16-21-8-9-22-16)18(26)17-15-7-5-4-6-13(15)10-14(12-25)24-17/h4-9,12,14,17,19,23-24H,10-11H2,1-3H3,(H,21,22)