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

Systemtic Name: 3-[4-methyl-5-[(1S)-2-oxidanylidene-1-phenyl-2-phenylazanyl-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[(1S)-2-anilino-2-oxo-1-phenyl-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[[(1S)-2-anilino-2-oxo-1-phenylethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(1S)-2-anilino-2-oxo-1-phenylethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[(1S)-2-anilino-2-keto-1-phenyl-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)NC3=CC=CC=C3)CCC(=O)N

Isomeric SMILES

CN1C(=NN=C1S[C@@H](C2=CC=CC=C2)C(=O)NC3=CC=CC=C3)CCC(=O)N

InChI

InChI=1S/C20H21N5O2S/c1-25-17(13-12-16(21)26)23-24-20(25)28-18(14-8-4-2-5-9-14)19(27)22-15-10-6-3-7-11-15/h2-11,18H,12-13H2,1H3,(H2,21,26)(H,22,27)/t18-/m0/s1