(2R)-N-(2-ethanoylphenyl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(2-ethanoylphenyl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(2-acetylphenyl)-2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-N-(2-acetylphenyl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-(2-acetylphenyl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(2-acetylphenyl)-2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=O)C)SC2=NN=C(N2CC=C)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C(=O)C)SC2=NN=C(N2CC=C)C3=CC=CC=C3

InChI

InChI=1S/C22H22N4O2S/c1-4-14-26-20(17-10-6-5-7-11-17)24-25-22(26)29-16(3)21(28)23-19-13-9-8-12-18(19)15(2)27/h4-13,16H,1,14H2,2-3H3,(H,23,28)/t16-/m1/s1