2-[2-methyl-3-[(2-propan-2-ylimidazol-1-yl)methyl]phenyl]sulfanylethyl N-phenylcarbamate

Systemtic Name: 2-[2-methyl-3-[(2-propan-2-ylimidazol-1-yl)methyl]phenyl]sulfanylethyl N-phenylcarbamate Openeye Name: 2-[3-[(2-isopropylimidazol-1-yl)methyl]-2-methyl-phenyl]sulfanylethyl N-phenylcarbamate CAS Name: N-phenylcarbamic acid 2-[[2-methyl-3-[(2-propan-2-yl-1-imidazolyl)methyl]phenyl]thio]ethyl ester IUPAC Name: 2-[2-methyl-3-[(2-propan-2-ylimidazol-1-yl)methyl]phenyl]sulfanylethyl N-phenylcarbamate Traditional Name: N-phenylcarbamic acid 2-[[3-[(2-isopropylimidazol-1-yl)methyl]-2-methyl-phenyl]thio]ethyl ester Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCOC(=O)NC2=CC=CC=C2)CN3C=CN=C3C(C)C

Isomeric SMILES

CC1=C(C=CC=C1SCCOC(=O)NC2=CC=CC=C2)CN3C=CN=C3C(C)C

InChI

InChI=1S/C23H27N3O2S/c1-17(2)22-24-12-13-26(22)16-19-8-7-11-21(18(19)3)29-15-14-28-23(27)25-20-9-5-4-6-10-20/h4-13,17H,14-16H2,1-3H3,(H,25,27)