tert-butyl N-[1-(2-carbamothioylphenyl)-3-oxidanyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-(2-carbamothioylphenyl)-3-oxidanyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[(2-carbamothioylphenyl)methyl]-2-hydroxy-ethyl]carbamate CAS Name: N-[1-(2-carbamothioylphenyl)-3-hydroxypropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(2-carbamothioylphenyl)-3-hydroxypropan-2-yl]carbamate Traditional Name: N-[1-methylol-2-(2-thiocarbamoylphenyl)ethyl]carbamic acid tert-butyl ester Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1C(=S)N)CO

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1C(=S)N)CO

InChI

InChI=1S/C15H22N2O3S/c1-15(2,3)20-14(19)17-11(9-18)8-10-6-4-5-7-12(10)13(16)21/h4-7,11,18H,8-9H2,1-3H3,(H2,16,21)(H,17,19)