(4-tert-butylphenyl) N-pyridin-3-ylcarbothioylcarbamate

Systemtic Name: (4-tert-butylphenyl) N-pyridin-3-ylcarbothioylcarbamate Openeye Name: (4-tert-butylphenyl) N-(pyridine-3-carbothioyl)carbamate CAS Name: N-[3-pyridinyl(sulfanylidene)methyl]carbamic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) N-(pyridine-3-carbothioyl)carbamate Traditional Name: N-(pyridine-3-carbothioyl)carbamic acid (4-tert-butylphenyl) ester Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC(=O)NC(=S)C2=CN=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC(=O)NC(=S)C2=CN=CC=C2

InChI

InChI=1S/C17H18N2O2S/c1-17(2,3)13-6-8-14(9-7-13)21-16(20)19-15(22)12-5-4-10-18-11-12/h4-11H,1-3H3,(H,19,20,22)