(2S)-2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: (2S)-2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: (2S)-2-indan-5-ylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: (2S)-2-(2,3-dihydro-1H-inden-5-ylthio)-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: (2S)-2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: (2S)-2-(indan-5-ylthio)-N-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)C(C)SC2=CC3=C(CCC3)C=C2

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)[C@H](C)SC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C18H23N3OS/c1-11-17(12(2)21(4)20-11)19-18(22)13(3)23-16-9-8-14-6-5-7-15(14)10-16/h8-10,13H,5-7H2,1-4H3,(H,19,22)/t13-/m0/s1