tert-butyl N-[1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbothioyl)hydrazinyl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbothioyl)hydrazinyl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-[2-(2,3-dihydro-1,4-benzodioxine-6-carbothioyl)hydrazino]-2-oxo-ethyl]carbamate CAS Name: N-[1-[[2,3-dihydro-1,4-benzodioxin-6-yl(sulfanylidene)methyl]hydrazo]-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[2-(2,3-dihydro-1,4-benzodioxine-6-carbothioyl)hydrazinyl]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[N'-(2,3-dihydro-1,4-benzodioxin-6-carbothioyl)hydrazino]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NNC(=S)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NNC(=S)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C23H27N3O5S/c1-23(2,3)31-22(28)24-17(13-15-7-5-4-6-8-15)20(27)25-26-21(32)16-9-10-18-19(14-16)30-12-11-29-18/h4-10,14,17H,11-13H2,1-3H3,(H,24,28)(H,25,27)(H,26,32)