(E)-3-[4-[2-(diphenylmethyl)sulfanylethanoylamino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[2-(diphenylmethyl)sulfanylethanoylamino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[(2-benzhydrylsulfanylacetyl)amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[2-[(diphenylmethyl)thio]-1-oxoethyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[(2-benzhydrylsulfanylacetyl)amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[[2-(benzhydrylthio)acetyl]amino]phenyl]acrylic acid Formula: C24H21NO3S MolecularWeight: 403.49344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)SCC(=O)NC3=CC=C(C=C3)C=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)SCC(=O)NC3=CC=C(C=C3)/C=C/C(=O)O

InChI

InChI=1S/C24H21NO3S/c26-22(25-21-14-11-18(12-15-21)13-16-23(27)28)17-29-24(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-16,24H,17H2,(H,25,26)(H,27,28)/b16-13+