(E)-3-(5-bromanyl-2-methoxy-phenyl)-2-(4-oxidanylidene-1,3-benzothiazin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-2-(4-oxidanylidene-1,3-benzothiazin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-2-(4-oxo-1,3-benzothiazin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-2-(4-oxo-1,3-benzothiazin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-2-(4-oxo-1,3-benzothiazin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-2-(4-keto-1,3-benzothiazin-2-yl)acrylonitrile Formula: C18H11BrN2O2S MolecularWeight: 399.26114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=C(C#N)C2=NC(=O)C3=CC=CC=C3S2

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C(\C#N)/C2=NC(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C18H11BrN2O2S/c1-23-15-7-6-13(19)9-11(15)8-12(10-20)18-21-17(22)14-4-2-3-5-16(14)24-18/h2-9H,1H3/b12-8+