S-(4-tert-butylphenyl) N-(1H-imidazol-2-yl)carbamothioate

Systemtic Name: S-(4-tert-butylphenyl) N-(1H-imidazol-2-yl)carbamothioate Openeye Name: S-(4-tert-butylphenyl) N-(1H-imidazol-2-yl)carbamothioate CAS Name: N-(1H-imidazol-2-yl)carbamothioic acid S-(4-tert-butylphenyl) ester IUPAC Name: S-(4-tert-butylphenyl) N-(1H-imidazol-2-yl)carbamothioate Traditional Name: N-(1H-imidazol-2-yl)thiocarbamic acid S-(4-tert-butylphenyl) ester Formula: C14H17N3OS MolecularWeight: 275.36928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC(=O)NC2=NC=CN2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC(=O)NC2=NC=CN2

InChI

InChI=1S/C14H17N3OS/c1-14(2,3)10-4-6-11(7-5-10)19-13(18)17-12-15-8-9-16-12/h4-9H,1-3H3,(H2,15,16,17,18)