2-azanyl-5-methyl-4-(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)thiophene-3-carbonitrile

Systemtic Name: 2-azanyl-5-methyl-4-(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)thiophene-3-carbonitrile Openeye Name: 2-amino-5-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)thiophene-3-carbonitrile CAS Name: 2-amino-5-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)-3-thiophenecarbonitrile IUPAC Name: 2-amino-5-methyl-4-(2-oxo-3H-1,3-benzoxazol-6-yl)thiophene-3-carbonitrile Traditional Name: 2-amino-4-(2-keto-3H-1,3-benzoxazol-6-yl)-5-methyl-thiophene-3-carbonitrile Formula: C13H9N3O2S MolecularWeight: 271.29446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)N)C#N)C2=CC3=C(C=C2)NC(=O)O3

Isomeric SMILES

CC1=C(C(=C(S1)N)C#N)C2=CC3=C(C=C2)NC(=O)O3

InChI

InChI=1S/C13H9N3O2S/c1-6-11(8(5-14)12(15)19-6)7-2-3-9-10(4-7)18-13(17)16-9/h2-4H,15H2,1H3,(H,16,17)