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

Systemtic Name: 4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]quinoline-3-carbonitrile Openeye Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-[5-(1,3-dioxolan-2-yl)-2-thienyl]quinoline-3-carbonitrile CAS Name: 4-(2,4-dichloro-5-methoxyanilino)-7-[5-(1,3-dioxolan-2-yl)-2-thiophenyl]-3-quinolinecarbonitrile IUPAC Name: 4-(2,4-dichloro-5-methoxyanilino)-7-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]quinoline-3-carbonitrile Traditional Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-[5-(1,3-dioxolan-2-yl)-2-thienyl]quinoline-3-carbonitrile Formula: C24H17Cl2N3O3S MolecularWeight: 498.38108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC=C(S4)C5OCCO5)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC=C(S4)C5OCCO5)Cl)Cl

InChI

InChI=1S/C24H17Cl2N3O3S/c1-30-20-10-19(16(25)9-17(20)26)29-23-14(11-27)12-28-18-8-13(2-3-15(18)23)21-4-5-22(33-21)24-31-6-7-32-24/h2-5,8-10,12,24H,6-7H2,1H3,(H,28,29)