tert-butyl N-[(3,4-dimethoxyphenyl)carbamothioylamino]carbamate

Systemtic Name: tert-butyl N-[(3,4-dimethoxyphenyl)carbamothioylamino]carbamate Openeye Name: tert-butyl N-[(3,4-dimethoxyphenyl)carbamothioylamino]carbamate CAS Name: N-[[(3,4-dimethoxyanilino)-sulfanylidenemethyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3,4-dimethoxyphenyl)carbamothioylamino]carbamate Traditional Name: N-[(3,4-dimethoxyphenyl)thiocarbamoylamino]carbamic acid tert-butyl ester Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NNC(=S)NC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)NNC(=S)NC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C14H21N3O4S/c1-14(2,3)21-13(18)17-16-12(22)15-9-6-7-10(19-4)11(8-9)20-5/h6-8H,1-5H3,(H,17,18)(H2,15,16,22)