3-anthracen-9-yl-2-(1,3-benzothiazol-2-ylsulfanyl)prop-2-enenitrile

Systemtic Name: 3-anthracen-9-yl-2-(1,3-benzothiazol-2-ylsulfanyl)prop-2-enenitrile Openeye Name: 3-(9-anthryl)-2-(1,3-benzothiazol-2-ylsulfanyl)prop-2-enenitrile CAS Name: 3-(9-anthracenyl)-2-(1,3-benzothiazol-2-ylthio)-2-propenenitrile IUPAC Name: 3-anthracen-9-yl-2-(1,3-benzothiazol-2-ylsulfanyl)prop-2-enenitrile Traditional Name: 3-(9-anthryl)-2-(1,3-benzothiazol-2-ylthio)acrylonitrile Formula: C24H14N2S2 MolecularWeight: 394.51136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=C(C#N)SC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=C(C#N)SC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H14N2S2/c25-15-18(27-24-26-22-11-5-6-12-23(22)28-24)14-21-19-9-3-1-7-16(19)13-17-8-2-4-10-20(17)21/h1-14H