S-[(3S,4R)-2-oxidanylidene-1,3,4-triphenyl-azetidin-3-yl] N-methyl-N-(phenylmethyl)carbamothioate

Systemtic Name: S-[(3S,4R)-2-oxidanylidene-1,3,4-triphenyl-azetidin-3-yl] N-methyl-N-(phenylmethyl)carbamothioate Openeye Name: S-[(3S,4R)-2-oxo-1,3,4-triphenyl-azetidin-3-yl] N-benzyl-N-methyl-carbamothioate CAS Name: N-methyl-N-(phenylmethyl)carbamothioic acid S-[[(3S,4R)-2-oxo-1,3,4-triphenyl-3-azetidinyl]] ester IUPAC Name: S-[(3S,4R)-2-oxo-1,3,4-triphenylazetidin-3-yl] N-benzyl-N-methylcarbamothioate Traditional Name: N-benzyl-N-methyl-thiocarbamic acid S-[(3S,4R)-2-keto-1,3,4-triphenyl-azetidin-3-yl] ester Formula: C30H26N2O2S MolecularWeight: 478.60464

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)SC2(C(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)S[C@]2([C@H](N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H26N2O2S/c1-31(22-23-14-6-2-7-15-23)29(34)35-30(25-18-10-4-11-19-25)27(24-16-8-3-9-17-24)32(28(30)33)26-20-12-5-13-21-26/h2-21,27H,22H2,1H3/t27-,30+/m1/s1