2,5-bis[(E)-2-(10-ethylphenothiazin-3-yl)ethenyl]benzene-1,4-dicarbonitrile

Systemtic Name: 2,5-bis[(E)-2-(10-ethylphenothiazin-3-yl)ethenyl]benzene-1,4-dicarbonitrile Openeye Name: 2,5-bis[(E)-2-(10-ethylphenothiazin-3-yl)vinyl]terephthalonitrile CAS Name: 2,5-bis[(E)-2-(10-ethyl-3-phenothiazinyl)ethenyl]benzene-1,4-dicarbonitrile IUPAC Name: 2,5-bis[(E)-2-(10-ethylphenothiazin-3-yl)ethenyl]benzene-1,4-dicarbonitrile Traditional Name: 2,5-bis[(E)-2-(10-ethylphenothiazin-3-yl)vinyl]terephthalonitrile Formula: C40H30N4S2 MolecularWeight: 630.823

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C=CC3=CC(=C(C=C3C#N)C=CC4=CC5=C(C=C4)N(C6=CC=CC=C6S5)CC)C#N)SC7=CC=CC=C71

Isomeric SMILES

CCN1C2=C(C=C(C=C2)/C=C/C3=CC(=C(C=C3C#N)/C=C/C4=CC5=C(C=C4)N(C6=CC=CC=C6S5)CC)C#N)SC7=CC=CC=C71

InChI

InChI=1S/C40H30N4S2/c1-3-43-33-9-5-7-11-37(33)45-39-21-27(15-19-35(39)43)13-17-29-23-32(26-42)30(24-31(29)25-41)18-14-28-16-20-36-40(22-28)46-38-12-8-6-10-34(38)44(36)4-2/h5-24H,3-4H2,1-2H3/b17-13+,18-14+