(2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]butanamide

Systemtic Name: (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]butanamide Openeye Name: (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]butanamide CAS Name: (2S)-3-methyl-2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]butanamide IUPAC Name: (2S)-3-methyl-2-[(2-naphthalen-1-ylacetyl)amino]-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]butanamide Traditional Name: (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]butyramide Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C)C1=CC=C(C=C1)S(=O)(=O)N)NC(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)S(=O)(=O)N)NC(=O)[C@H](C(C)C)NC(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C25H29N3O4S/c1-16(2)24(25(30)27-17(3)18-11-13-21(14-12-18)33(26,31)32)28-23(29)15-20-9-6-8-19-7-4-5-10-22(19)20/h4-14,16-17,24H,15H2,1-3H3,(H,27,30)(H,28,29)(H2,26,31,32)/t17-,24+/m1/s1