tert-butyl N-(5-carbamothioylpyridin-2-yl)carbamate

Systemtic Name: tert-butyl N-(5-carbamothioylpyridin-2-yl)carbamate Openeye Name: tert-butyl N-(5-carbamothioyl-2-pyridyl)carbamate CAS Name: N-(5-carbamothioyl-2-pyridinyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(5-carbamothioylpyridin-2-yl)carbamate Traditional Name: N-(5-thiocarbamoyl-2-pyridyl)carbamic acid tert-butyl ester Formula: C11H15N3O2S MolecularWeight: 253.3207

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=NC=C(C=C1)C(=S)N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=NC=C(C=C1)C(=S)N

InChI

InChI=1S/C11H15N3O2S/c1-11(2,3)16-10(15)14-8-5-4-7(6-13-8)9(12)17/h4-6H,1-3H3,(H2,12,17)(H,13,14,15)