N-butyl-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-carbothioamide

Systemtic Name: N-butyl-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-carbothioamide Openeye Name: N-butyl-3-methyl-2-oxo-1,3-benzoxazole-6-carbothioamide CAS Name: N-butyl-3-methyl-2-oxo-1,3-benzoxazole-6-carbothioamide IUPAC Name: N-butyl-3-methyl-2-oxo-1,3-benzoxazole-6-carbothioamide Traditional Name: N-butyl-2-keto-3-methyl-1,3-benzoxazole-6-carbothioamide Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)C1=CC2=C(C=C1)N(C(=O)O2)C

Isomeric SMILES

CCCCNC(=S)C1=CC2=C(C=C1)N(C(=O)O2)C

InChI

InChI=1S/C13H16N2O2S/c1-3-4-7-14-12(18)9-5-6-10-11(8-9)17-13(16)15(10)2/h5-6,8H,3-4,7H2,1-2H3,(H,14,18)