(2S)-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanylidene-propan-2-yl]-3-methyl-2-(naphthalen-2-ylsulfonylamino)pentanamide

Systemtic Name: (2S)-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanylidene-propan-2-yl]-3-methyl-2-(naphthalen-2-ylsulfonylamino)pentanamide Openeye Name: (2S)-N-[(1R)-1-formyl-2-(1H-indol-3-yl)ethyl]-3-methyl-2-(2-naphthylsulfonylamino)pentanamide CAS Name: (2S)-N-[(2R)-1-(1H-indol-3-yl)-3-oxopropan-2-yl]-3-methyl-2-(2-naphthalenylsulfonylamino)pentanamide IUPAC Name: (2S)-N-[(2R)-1-(1H-indol-3-yl)-3-oxopropan-2-yl]-3-methyl-2-(naphthalen-2-ylsulfonylamino)pentanamide Traditional Name: (2S)-N-[(1R)-1-formyl-2-(1H-indol-3-yl)ethyl]-3-methyl-2-(2-naphthylsulfonylamino)valeramide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CNC2=CC=CC=C21)C=O)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCC(C)[C@@H](C(=O)N[C@H](CC1=CNC2=CC=CC=C21)C=O)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H29N3O4S/c1-3-18(2)26(30-35(33,34)23-13-12-19-8-4-5-9-20(19)15-23)27(32)29-22(17-31)14-21-16-28-25-11-7-6-10-24(21)25/h4-13,15-18,22,26,28,30H,3,14H2,1-2H3,(H,29,32)/t18?,22-,26+/m1/s1