(2S)-N-[2-[(2S)-butan-2-yl]pyrazol-3-yl]-2-naphthalen-2-ylsulfanyl-propanamide

Systemtic Name: (2S)-N-[2-[(2S)-butan-2-yl]pyrazol-3-yl]-2-naphthalen-2-ylsulfanyl-propanamide Openeye Name: (2S)-N-[2-[(1S)-1-methylpropyl]pyrazol-3-yl]-2-(2-naphthylsulfanyl)propanamide CAS Name: (2S)-N-[2-[(2S)-butan-2-yl]-3-pyrazolyl]-2-(2-naphthalenylthio)propanamide IUPAC Name: (2S)-N-[2-[(2S)-butan-2-yl]pyrazol-3-yl]-2-naphthalen-2-ylsulfanylpropanamide Traditional Name: (2S)-N-[2-[(1S)-1-methylpropyl]pyrazol-3-yl]-2-(2-naphthylthio)propionamide Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=CC=N1)NC(=O)C(C)SC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC[C@H](C)N1C(=CC=N1)NC(=O)[C@H](C)SC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H23N3OS/c1-4-14(2)23-19(11-12-21-23)22-20(24)15(3)25-18-10-9-16-7-5-6-8-17(16)13-18/h5-15H,4H2,1-3H3,(H,22,24)/t14-,15-/m0/s1