(2,4-dimethyl-1,3-oxazol-5-yl)-[2-oxidanylidene-4-(triphenylmethyl)-1,2-thiazetidin-2-ium-3-yl]methanol

Systemtic Name: (2,4-dimethyl-1,3-oxazol-5-yl)-[2-oxidanylidene-4-(triphenylmethyl)-1,2-thiazetidin-2-ium-3-yl]methanol Openeye Name: (2,4-dimethyloxazol-5-yl)-(2-oxo-4-trityl-thiazetidin-2-ium-3-yl)methanol CAS Name: (2,4-dimethyl-5-oxazolyl)-[2-oxo-4-(triphenylmethyl)-3-thiazetidin-2-iumyl]methanol IUPAC Name: (2,4-dimethyl-1,3-oxazol-5-yl)-(2-oxo-4-tritylthiazetidin-2-ium-3-yl)methanol Traditional Name: (2,4-dimethyloxazol-5-yl)-(2-keto-4-trityl-thiazetidin-2-ium-3-yl)methanol Formula: C27H25N2O3S+ MolecularWeight: 457.564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=N1)C)C(C2C(S[N+]2=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

CC1=C(OC(=N1)C)C(C2C(S[N+]2=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C27H25N2O3S/c1-18-25(32-19(2)28-18)24(30)23-26(33-29(23)31)27(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22/h3-17,23-24,26,30H,1-2H3/q+1