N-[(2S)-3-naphthalen-2-yl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]propan-2-yl]quinoline-6-carboxamide

Systemtic Name: N-[(2S)-3-naphthalen-2-yl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]propan-2-yl]quinoline-6-carboxamide Openeye Name: N-[(1S)-1-(2-naphthylmethyl)-2-oxo-2-[[(4S)-3-oxo-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]quinoline-6-carboxamide CAS Name: N-[(2S)-3-(2-naphthalenyl)-1-oxo-1-[[(4S)-3-oxo-1-(2-pyridinylsulfonyl)-4-azepanyl]amino]propan-2-yl]-6-quinolinecarboxamide IUPAC Name: N-[(2S)-3-naphthalen-2-yl-1-oxo-1-[[(4S)-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl]amino]propan-2-yl]quinoline-6-carboxamide Traditional Name: N-[(1S)-2-keto-2-[[(4S)-3-keto-1-(2-pyridylsulfonyl)azepan-4-yl]amino]-1-(2-naphthylmethyl)ethyl]quinoline-6-carboxamide Formula: C34H31N5O5S MolecularWeight: 621.70544

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)CN(C1)S(=O)(=O)C2=CC=CC=N2)NC(=O)C(CC3=CC4=CC=CC=C4C=C3)NC(=O)C5=CC6=C(C=C5)N=CC=C6

Isomeric SMILES

C1C[C@@H](C(=O)CN(C1)S(=O)(=O)C2=CC=CC=N2)NC(=O)[C@H](CC3=CC4=CC=CC=C4C=C3)NC(=O)C5=CC6=C(C=C5)N=CC=C6

InChI

InChI=1S/C34H31N5O5S/c40-31-22-39(45(43,44)32-11-3-4-16-36-32)18-6-10-29(31)37-34(42)30(20-23-12-13-24-7-1-2-8-25(24)19-23)38-33(41)27-14-15-28-26(21-27)9-5-17-35-28/h1-5,7-9,11-17,19,21,29-30H,6,10,18,20,22H2,(H,37,42)(H,38,41)/t29-,30-/m0/s1