(1E)-3-[2-[4-(phenethylsulfanylmethyl)phenyl]phenyl]-N-thiophen-2-ylsulfonyl-propanimidate

Systemtic Name: (1E)-3-[2-[4-(phenethylsulfanylmethyl)phenyl]phenyl]-N-thiophen-2-ylsulfonyl-propanimidate Openeye Name: (1E)-3-[2-[4-(phenethylsulfanylmethyl)phenyl]phenyl]-N-(2-thienylsulfonyl)propanimidate CAS Name: (1E)-3-[2-[4-[(phenethylthio)methyl]phenyl]phenyl]-N-thiophen-2-ylsulfonylpropanimidate IUPAC Name: (1E)-3-[2-[4-(phenethylsulfanylmethyl)phenyl]phenyl]-N-thiophen-2-ylsulfonylpropanimidate Traditional Name: (1E)-3-[2-[4-[(phenethylthio)methyl]phenyl]phenyl]-N-(2-thienylsulfonyl)propionimidate Formula: C28H26NO3S3- MolecularWeight: 520.70594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSCC2=CC=C(C=C2)C3=CC=CC=C3CCC(=NS(=O)(=O)C4=CC=CS4)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCSCC2=CC=C(C=C2)C3=CC=CC=C3CC/C(=N\S(=O)(=O)C4=CC=CS4)/[O-]

InChI

InChI=1S/C28H27NO3S3/c30-27(29-35(31,32)28-11-6-19-34-28)17-16-24-9-4-5-10-26(24)25-14-12-23(13-15-25)21-33-20-18-22-7-2-1-3-8-22/h1-15,19H,16-18,20-21H2,(H,29,30)/p-1