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

Systemtic Name: (1E)-3-[2-[3-(phenethylsulfanylmethyl)phenyl]phenyl]-N-thiophen-2-ylsulfonyl-propanimidate Openeye Name: (1E)-3-[2-[3-(phenethylsulfanylmethyl)phenyl]phenyl]-N-(2-thienylsulfonyl)propanimidate CAS Name: (1E)-3-[2-[3-[(phenethylthio)methyl]phenyl]phenyl]-N-thiophen-2-ylsulfonylpropanimidate IUPAC Name: (1E)-3-[2-[3-(phenethylsulfanylmethyl)phenyl]phenyl]-N-thiophen-2-ylsulfonylpropanimidate Traditional Name: (1E)-3-[2-[3-[(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=CC(=C2)C3=CC=CC=C3CCC(=NS(=O)(=O)C4=CC=CS4)[O-]

Isomeric SMILES

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

InChI

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