ethyl (E)-3-[4-[2-(diphenylmethyl)sulfanylethanoylamino]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[2-(diphenylmethyl)sulfanylethanoylamino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-[(2-benzhydrylsulfanylacetyl)amino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[2-[(diphenylmethyl)thio]-1-oxoethyl]amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[(2-benzhydrylsulfanylacetyl)amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[[2-(benzhydrylthio)acetyl]amino]phenyl]acrylic acid ethyl ester Formula: C26H25NO3S MolecularWeight: 431.5466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC=C(C=C1)NC(=O)CSC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C=C/C1=CC=C(C=C1)NC(=O)CSC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H25NO3S/c1-2-30-25(29)18-15-20-13-16-23(17-14-20)27-24(28)19-31-26(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-18,26H,2,19H2,1H3,(H,27,28)/b18-15+