(3S)-3-(benzenecarbonothioylamino)-4-methyl-1-phenyl-2-(phenylcarbonyl)pent-1-en-1-olate

Systemtic Name: (3S)-3-(benzenecarbonothioylamino)-4-methyl-1-phenyl-2-(phenylcarbonyl)pent-1-en-1-olate Openeye Name: (3S)-3-(benzenecarbonothioylamino)-2-benzoyl-4-methyl-1-phenyl-pent-1-en-1-olate CAS Name: (3S)-3-(benzenecarbonothioylamino)-2-benzoyl-4-methyl-1-phenyl-1-penten-1-olate IUPAC Name: (3S)-3-(benzenecarbonothioylamino)-2-benzoyl-4-methyl-1-phenylpent-1-en-1-olate Traditional Name: (3S)-3-(benzenecarbonothioylamino)-2-benzoyl-4-methyl-1-phenyl-pent-1-en-1-olate Formula: C26H24NO2S- MolecularWeight: 414.53926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=C(C1=CC=CC=C1)[O-])C(=O)C2=CC=CC=C2)NC(=S)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=C(C1=CC=CC=C1)[O-])C(=O)C2=CC=CC=C2)NC(=S)C3=CC=CC=C3

InChI

InChI=1S/C26H25NO2S/c1-18(2)23(27-26(30)21-16-10-5-11-17-21)22(24(28)19-12-6-3-7-13-19)25(29)20-14-8-4-9-15-20/h3-18,23,28H,1-2H3,(H,27,30)/p-1/t23-/m0/s1