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

Systemtic Name: S-[(2S,3S)-2-(4-methoxyphenyl)-4-oxidanylidene-1,3-diphenyl-azetidin-3-yl] N-methyl-N-(phenylmethyl)carbamothioate Openeye Name: S-[(2S,3S)-2-(4-methoxyphenyl)-4-oxo-1,3-diphenyl-azetidin-3-yl] N-benzyl-N-methyl-carbamothioate CAS Name: N-methyl-N-(phenylmethyl)carbamothioic acid S-[[(2S,3S)-2-(4-methoxyphenyl)-4-oxo-1,3-diphenyl-3-azetidinyl]] ester IUPAC Name: S-[(2S,3S)-2-(4-methoxyphenyl)-4-oxo-1,3-diphenylazetidin-3-yl] N-benzyl-N-methylcarbamothioate Traditional Name: N-benzyl-N-methyl-thiocarbamic acid S-[(3S,4S)-2-keto-4-(4-methoxyphenyl)-1,3-diphenyl-azetidin-3-yl] ester Formula: C31H28N2O3S MolecularWeight: 508.63062

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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=C(C=C4)OC)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=C(C=C4)OC)C5=CC=CC=C5

InChI

InChI=1S/C31H28N2O3S/c1-32(22-23-12-6-3-7-13-23)30(35)37-31(25-14-8-4-9-15-25)28(24-18-20-27(36-2)21-19-24)33(29(31)34)26-16-10-5-11-17-26/h3-21,28H,22H2,1-2H3/t28-,31-/m0/s1