(E)-3-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)prop-2-enenitrile Openeye Name: (E)-3-(2-methyl-3-thioxo-4H-1,4-benzoxazin-6-yl)prop-2-enenitrile CAS Name: (E)-3-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)-2-propenenitrile IUPAC Name: (E)-3-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-methyl-3-thioxo-4H-1,4-benzoxazin-6-yl)acrylonitrile Formula: C12H10N2OS MolecularWeight: 230.2856

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=S)NC2=C(O1)C=CC(=C2)C=CC#N

Isomeric SMILES

CC1C(=S)NC2=C(O1)C=CC(=C2)/C=C/C#N

InChI

InChI=1S/C12H10N2OS/c1-8-12(16)14-10-7-9(3-2-6-13)4-5-11(10)15-8/h2-5,7-8H,1H3,(H,14,16)/b3-2+