3-[5-[(2R)-1-(4-acetamidophenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-[(2R)-1-(4-acetamidophenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[(1R)-2-(4-acetamidophenyl)-1-methyl-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[[(2R)-1-(4-acetamidophenyl)-1-oxopropan-2-yl]thio]-4-methyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(2R)-1-(4-acetamidophenyl)-1-oxopropan-2-yl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[(1R)-2-(4-acetamidophenyl)-2-keto-1-methyl-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C17H21N5O3S MolecularWeight: 375.44534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)NC(=O)C)SC2=NN=C(N2C)CCC(=O)N

Isomeric SMILES

C[C@H](C(=O)C1=CC=C(C=C1)NC(=O)C)SC2=NN=C(N2C)CCC(=O)N

InChI

InChI=1S/C17H21N5O3S/c1-10(16(25)12-4-6-13(7-5-12)19-11(2)23)26-17-21-20-15(22(17)3)9-8-14(18)24/h4-7,10H,8-9H2,1-3H3,(H2,18,24)(H,19,23)/t10-/m1/s1