(3R,4S)-N'-isoquinolin-1-ylcarbonyl-3-(4-methoxyphenyl)-2-(2-methylpropyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carbohydrazide

Systemtic Name: (3R,4S)-N'-isoquinolin-1-ylcarbonyl-3-(4-methoxyphenyl)-2-(2-methylpropyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carbohydrazide Openeye Name: (3R,4S)-2-isobutyl-N'-(isoquinoline-1-carbonyl)-3-(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carbohydrazide CAS Name: (3R,4S)-N'-[1-isoquinolinyl(oxo)methyl]-3-(4-methoxyphenyl)-2-(2-methylpropyl)-1-oxo-3,4-dihydroisoquinoline-4-carbohydrazide IUPAC Name: (3R,4S)-N'-(isoquinoline-1-carbonyl)-3-(4-methoxyphenyl)-2-(2-methylpropyl)-1-oxo-3,4-dihydroisoquinoline-4-carbohydrazide Traditional Name: (3R,4S)-2-isobutyl-N'-(isoquinoline-1-carbonyl)-1-keto-3-(4-methoxyphenyl)-3,4-dihydroisoquinoline-4-carbohydrazide Formula: C31H30N4O4 MolecularWeight: 522.5943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(C(C2=CC=CC=C2C1=O)C(=O)NNC(=O)C3=NC=CC4=CC=CC=C43)C5=CC=C(C=C5)OC

Isomeric SMILES

CC(C)CN1[C@H]([C@H](C2=CC=CC=C2C1=O)C(=O)NNC(=O)C3=NC=CC4=CC=CC=C43)C5=CC=C(C=C5)OC

InChI

InChI=1S/C31H30N4O4/c1-19(2)18-35-28(21-12-14-22(39-3)15-13-21)26(24-10-6-7-11-25(24)31(35)38)29(36)33-34-30(37)27-23-9-5-4-8-20(23)16-17-32-27/h4-17,19,26,28H,18H2,1-3H3,(H,33,36)(H,34,37)/t26-,28-/m0/s1