(E)-3-(4-bromophenyl)-2-(4-oxidanylidene-1,3-benzothiazin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(4-bromophenyl)-2-(4-oxidanylidene-1,3-benzothiazin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(4-bromophenyl)-2-(4-oxo-1,3-benzothiazin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(4-bromophenyl)-2-(4-oxo-1,3-benzothiazin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(4-bromophenyl)-2-(4-oxo-1,3-benzothiazin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(4-bromophenyl)-2-(4-keto-1,3-benzothiazin-2-yl)acrylonitrile Formula: C17H9BrN2OS MolecularWeight: 369.23516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(S2)C(=CC3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(S2)/C(=C/C3=CC=C(C=C3)Br)/C#N

InChI

InChI=1S/C17H9BrN2OS/c18-13-7-5-11(6-8-13)9-12(10-19)17-20-16(21)14-3-1-2-4-15(14)22-17/h1-9H/b12-9+