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

Systemtic Name: S-[(3R,4S)-1-(4-methoxyphenyl)-2-oxidanylidene-3-phenyl-4-(phenylmethyl)azetidin-3-yl] N-methyl-N-(phenylmethyl)carbamothioate Openeye Name: S-[(2S,3R)-2-benzyl-1-(4-methoxyphenyl)-4-oxo-3-phenyl-azetidin-3-yl] N-benzyl-N-methyl-carbamothioate CAS Name: N-methyl-N-(phenylmethyl)carbamothioic acid S-[[(3R,4S)-1-(4-methoxyphenyl)-2-oxo-3-phenyl-4-(phenylmethyl)-3-azetidinyl]] ester IUPAC Name: S-[(2S,3R)-2-benzyl-1-(4-methoxyphenyl)-4-oxo-3-phenylazetidin-3-yl] N-benzyl-N-methylcarbamothioate Traditional Name: N-benzyl-N-methyl-thiocarbamic acid S-[(2S,3R)-2-benzyl-4-keto-1-(4-methoxyphenyl)-3-phenyl-azetidin-3-yl] ester Formula: C32H30N2O3S MolecularWeight: 522.6572

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)SC2(C(N(C2=O)C3=CC=C(C=C3)OC)CC4=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=C(C=C3)OC)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H30N2O3S/c1-33(23-25-14-8-4-9-15-25)31(36)38-32(26-16-10-5-11-17-26)29(22-24-12-6-3-7-13-24)34(30(32)35)27-18-20-28(37-2)21-19-27/h3-21,29H,22-23H2,1-2H3/t29-,32+/m0/s1