S-(2H-1,3-benzoxazol-3-yl) N-butylcarbamothioate

Systemtic Name: S-(2H-1,3-benzoxazol-3-yl) N-butylcarbamothioate Openeye Name: S-(2H-1,3-benzoxazol-3-yl) N-butylcarbamothioate CAS Name: N-butylcarbamothioic acid S-(2H-1,3-benzoxazol-3-yl) ester IUPAC Name: S-(2H-1,3-benzoxazol-3-yl) N-butylcarbamothioate Traditional Name: N-butylthiocarbamic acid S-(2H-1,3-benzoxazol-3-yl) ester Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)SN1COC2=CC=CC=C21

Isomeric SMILES

CCCCNC(=O)SN1COC2=CC=CC=C21

InChI

InChI=1S/C12H16N2O2S/c1-2-3-8-13-12(15)17-14-9-16-11-7-5-4-6-10(11)14/h4-7H,2-3,8-9H2,1H3,(H,13,15)