2-methoxy-5-naphtho[3,2-b][1]benzothiol-11-yl-benzene-1,3-dicarbonitrile

Systemtic Name: 2-methoxy-5-naphtho[3,2-b][1]benzothiol-11-yl-benzene-1,3-dicarbonitrile Openeye Name: 2-methoxy-5-naphtho[3,2-b]benzothiophen-11-yl-benzene-1,3-dicarbonitrile CAS Name: 2-methoxy-5-(11-naphtho[3,2-b][1]benzothiolyl)benzene-1,3-dicarbonitrile IUPAC Name: 2-methoxy-5-naphtho[3,2-b][1]benzothiol-11-ylbenzene-1,3-dicarbonitrile Traditional Name: 2-methoxy-5-naphtho[3,2-b]benzothiophen-11-yl-isophthalonitrile Formula: C25H14N2OS MolecularWeight: 390.45646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C#N)C2=C3C4=CC=CC=C4SC3=CC5=CC=CC=C52)C#N

Isomeric SMILES

COC1=C(C=C(C=C1C#N)C2=C3C4=CC=CC=C4SC3=CC5=CC=CC=C52)C#N

InChI

InChI=1S/C25H14N2OS/c1-28-25-17(13-26)10-16(11-18(25)14-27)23-19-7-3-2-6-15(19)12-22-24(23)20-8-4-5-9-21(20)29-22/h2-12H,1H3