4-[[3-chloranyl-4-(1-methylimidazol-2-yl)sulfanyl-phenyl]amino]-6-methoxy-7-(4-methoxyphenyl)quinoline-3-carbonitrile

Systemtic Name: 4-[[3-chloranyl-4-(1-methylimidazol-2-yl)sulfanyl-phenyl]amino]-6-methoxy-7-(4-methoxyphenyl)quinoline-3-carbonitrile Openeye Name: 4-[3-chloro-4-(1-methylimidazol-2-yl)sulfanyl-anilino]-6-methoxy-7-(4-methoxyphenyl)quinoline-3-carbonitrile CAS Name: 4-[3-chloro-4-[(1-methyl-2-imidazolyl)thio]anilino]-6-methoxy-7-(4-methoxyphenyl)-3-quinolinecarbonitrile IUPAC Name: 4-[3-chloro-4-(1-methylimidazol-2-yl)sulfanylanilino]-6-methoxy-7-(4-methoxyphenyl)quinoline-3-carbonitrile Traditional Name: 4-[3-chloro-4-[(1-methylimidazol-2-yl)thio]anilino]-6-methoxy-7-(4-methoxyphenyl)quinoline-3-carbonitrile Formula: C28H22ClN5O2S MolecularWeight: 528.02458

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C=C(C=C2)NC3=C(C=NC4=CC(=C(C=C43)OC)C5=CC=C(C=C5)OC)C#N)Cl

Isomeric SMILES

CN1C=CN=C1SC2=C(C=C(C=C2)NC3=C(C=NC4=CC(=C(C=C43)OC)C5=CC=C(C=C5)OC)C#N)Cl

InChI

InChI=1S/C28H22ClN5O2S/c1-34-11-10-31-28(34)37-26-9-6-19(12-23(26)29)33-27-18(15-30)16-32-24-13-21(25(36-3)14-22(24)27)17-4-7-20(35-2)8-5-17/h4-14,16H,1-3H3,(H,32,33)