(2R)-N-(3-methoxyphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanamide

Systemtic Name: (2R)-N-(3-methoxyphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanamide Openeye Name: (2R)-2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methoxyphenyl)-2-phenyl-acetamide CAS Name: (2R)-N-(3-methoxyphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-2-phenylacetamide IUPAC Name: (2R)-N-(3-methoxyphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenylacetamide Traditional Name: (2R)-2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(3-methoxyphenyl)-2-phenyl-acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SC(C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=NN=C(N1CC=C)S[C@H](C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H22N4O2S/c1-4-13-25-15(2)23-24-21(25)28-19(16-9-6-5-7-10-16)20(26)22-17-11-8-12-18(14-17)27-3/h4-12,14,19H,1,13H2,2-3H3,(H,22,26)/t19-/m1/s1