N-(phenylmethyl)-2-[2-[(3S)-3-pyrrolidin-1-ylcarbonyl-3,4-dihydro-1H-isoquinolin-2-yl]ethanoylamino]benzamide

Systemtic Name: N-(phenylmethyl)-2-[2-[(3S)-3-pyrrolidin-1-ylcarbonyl-3,4-dihydro-1H-isoquinolin-2-yl]ethanoylamino]benzamide Openeye Name: N-benzyl-2-[[2-[(3S)-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetyl]amino]benzamide CAS Name: 2-[[1-oxo-2-[(3S)-3-[oxo(1-pyrrolidinyl)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[[2-[(3S)-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetyl]amino]benzamide Traditional Name: N-benzyl-2-[[2-[(3S)-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetyl]amino]benzamide Formula: C30H32N4O3 MolecularWeight: 496.60008

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CC3=CC=CC=C3CN2CC(=O)NC4=CC=CC=C4C(=O)NCC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H]2CC3=CC=CC=C3CN2CC(=O)NC4=CC=CC=C4C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C30H32N4O3/c35-28(32-26-15-7-6-14-25(26)29(36)31-19-22-10-2-1-3-11-22)21-34-20-24-13-5-4-12-23(24)18-27(34)30(37)33-16-8-9-17-33/h1-7,10-15,27H,8-9,16-21H2,(H,31,36)(H,32,35)/t27-/m0/s1