S-[[1-(triphenylmethyl)-1,2,3-triazol-4-yl]methyl] ethanethioate

Systemtic Name: S-[[1-(triphenylmethyl)-1,2,3-triazol-4-yl]methyl] ethanethioate Openeye Name: S-[(1-trityltriazol-4-yl)methyl] ethanethioate CAS Name: ethanethioic acid S-[[1-(triphenylmethyl)-4-triazolyl]methyl] ester IUPAC Name: S-[(1-trityltriazol-4-yl)methyl] ethanethioate Traditional Name: ethanethioic acid S-[(1-trityltriazol-4-yl)methyl] ester Formula: C24H21N3OS MolecularWeight: 399.50804

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=CN(N=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)SCC1=CN(N=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H21N3OS/c1-19(28)29-18-23-17-27(26-25-23)24(20-11-5-2-6-12-20,21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-17H,18H2,1H3