2-[3-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-4-oxidanylidene-1,3-benzothiazin-2-ylidene]ethanenitrile

Systemtic Name: 2-[3-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-4-oxidanylidene-1,3-benzothiazin-2-ylidene]ethanenitrile Openeye Name: 2-[3-[2-(4-chlorophenyl)-2-oxo-ethyl]-4-oxo-1,3-benzothiazin-2-ylidene]acetonitrile CAS Name: 2-[3-[2-(4-chlorophenyl)-2-oxoethyl]-4-oxo-1,3-benzothiazin-2-ylidene]acetonitrile IUPAC Name: 2-[3-[2-(4-chlorophenyl)-2-oxoethyl]-4-oxo-1,3-benzothiazin-2-ylidene]acetonitrile Traditional Name: 2-[3-[2-(4-chlorophenyl)-2-keto-ethyl]-4-keto-1,3-benzothiazin-2-ylidene]acetonitrile Formula: C18H11ClN2O2S MolecularWeight: 354.81014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H11ClN2O2S/c19-13-7-5-12(6-8-13)15(22)11-21-17(9-10-20)24-16-4-2-1-3-14(16)18(21)23/h1-9H,11H2