(2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]butanamide

Systemtic Name: (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]butanamide Openeye Name: (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]-N-[2-(2-thienylmethyl)pyrazol-3-yl]butanamide CAS Name: (2S)-3-methyl-2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]-N-[2-(thiophen-2-ylmethyl)-3-pyrazolyl]butanamide IUPAC Name: (2S)-3-methyl-2-[(2-naphthalen-1-ylacetyl)amino]-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]butanamide Traditional Name: (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]-N-[2-(2-thenyl)pyrazol-3-yl]butyramide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=NN1CC2=CC=CS2)NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC=NN1CC2=CC=CS2)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H26N4O2S/c1-17(2)24(25(31)27-22-12-13-26-29(22)16-20-10-6-14-32-20)28-23(30)15-19-9-5-8-18-7-3-4-11-21(18)19/h3-14,17,24H,15-16H2,1-2H3,(H,27,31)(H,28,30)/t24-/m0/s1