7-(1-benzothiophen-2-yl)-4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]quinoline-3-carbonitrile

Systemtic Name: 7-(1-benzothiophen-2-yl)-4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]quinoline-3-carbonitrile Openeye Name: 7-(benzothiophen-2-yl)-4-(2,4-dichloro-5-methoxy-anilino)quinoline-3-carbonitrile CAS Name: 7-(1-benzothiophen-2-yl)-4-(2,4-dichloro-5-methoxyanilino)-3-quinolinecarbonitrile IUPAC Name: 7-(1-benzothiophen-2-yl)-4-(2,4-dichloro-5-methoxyanilino)quinoline-3-carbonitrile Traditional Name: 7-(benzothiophen-2-yl)-4-(2,4-dichloro-5-methoxy-anilino)quinoline-3-carbonitrile Formula: C25H15Cl2N3OS MolecularWeight: 476.3771

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC5=CC=CC=C5S4)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC5=CC=CC=C5S4)Cl)Cl

InChI

InChI=1S/C25H15Cl2N3OS/c1-31-22-11-21(18(26)10-19(22)27)30-25-16(12-28)13-29-20-8-15(6-7-17(20)25)24-9-14-4-2-3-5-23(14)32-24/h2-11,13H,1H3,(H,29,30)