(2S)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-ethyl-N-phenyl-propanamide

Systemtic Name: (2S)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-ethyl-N-phenyl-propanamide Openeye Name: (2S)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-ethyl-N-phenyl-propanamide CAS Name: (2S)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-ethyl-N-phenylpropanamide IUPAC Name: (2S)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-ethyl-N-phenylpropanamide Traditional Name: (2S)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-ethyl-N-phenyl-propionamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C(C)SC2=NN=C(N2C)C3CC3

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)[C@H](C)SC2=NN=C(N2C)C3CC3

InChI

InChI=1S/C17H22N4OS/c1-4-21(14-8-6-5-7-9-14)16(22)12(2)23-17-19-18-15(20(17)3)13-10-11-13/h5-9,12-13H,4,10-11H2,1-3H3/t12-/m0/s1