S-(phenylmethyl) N-[1-(4-hydroxyphenyl)-2-methyl-propan-2-yl]carbamothioate

Systemtic Name: S-(phenylmethyl) N-[1-(4-hydroxyphenyl)-2-methyl-propan-2-yl]carbamothioate Openeye Name: S-benzyl N-[2-(4-hydroxyphenyl)-1,1-dimethyl-ethyl]carbamothioate CAS Name: N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]carbamothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]carbamothioate Traditional Name: N-[2-(4-hydroxyphenyl)-1,1-dimethyl-ethyl]thiocarbamic acid S-benzyl ester Formula: C18H21NO2S MolecularWeight: 315.42984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=C(C=C1)O)NC(=O)SCC2=CC=CC=C2

Isomeric SMILES

CC(C)(CC1=CC=C(C=C1)O)NC(=O)SCC2=CC=CC=C2

InChI

InChI=1S/C18H21NO2S/c1-18(2,12-14-8-10-16(20)11-9-14)19-17(21)22-13-15-6-4-3-5-7-15/h3-11,20H,12-13H2,1-2H3,(H,19,21)