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

Systemtic Name: (2S)-N-(3-methoxyphenyl)-2-phenyl-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: (2S)-2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methoxyphenyl)-2-phenyl-acetamide CAS Name: (2S)-N-(3-methoxyphenyl)-2-phenyl-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: (2S)-N-(3-methoxyphenyl)-2-phenyl-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: (2S)-2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-(3-methoxyphenyl)-2-phenyl-acetamide Formula: C26H24N4O2S MolecularWeight: 456.55936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)SC3=NN=C(N3CC=C)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)[C@H](C2=CC=CC=C2)SC3=NN=C(N3CC=C)C4=CC=CC=C4

InChI

InChI=1S/C26H24N4O2S/c1-3-17-30-24(20-13-8-5-9-14-20)28-29-26(30)33-23(19-11-6-4-7-12-19)25(31)27-21-15-10-16-22(18-21)32-2/h3-16,18,23H,1,17H2,2H3,(H,27,31)/t23-/m0/s1