6-isothiocyanato-3-methyl-1,3-benzoxazol-2-one

Systemtic Name: 6-isothiocyanato-3-methyl-1,3-benzoxazol-2-one Openeye Name: 6-isothiocyanato-3-methyl-1,3-benzoxazol-2-one CAS Name: 6-isothiocyanato-3-methyl-1,3-benzoxazol-2-one IUPAC Name: 6-isothiocyanato-3-methyl-1,3-benzoxazol-2-one Traditional Name: 6-isothiocyanato-3-methyl-1,3-benzoxazol-2-one Formula: C9H6N2O2S MolecularWeight: 206.22114

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)N=C=S)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)N=C=S)OC1=O

InChI

InChI=1S/C9H6N2O2S/c1-11-7-3-2-6(10-5-14)4-8(7)13-9(11)12/h2-4H,1H3