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

Systemtic Name: 4-[[3-chloranyl-4-(1-methylimidazol-2-yl)sulfanyl-phenyl]amino]-6-methoxy-7-[4-(morpholin-4-ylmethyl)phenyl]quinoline-3-carbonitrile Openeye Name: 4-[3-chloro-4-(1-methylimidazol-2-yl)sulfanyl-anilino]-6-methoxy-7-[4-(morpholinomethyl)phenyl]quinoline-3-carbonitrile CAS Name: 4-[3-chloro-4-[(1-methyl-2-imidazolyl)thio]anilino]-6-methoxy-7-[4-(4-morpholinylmethyl)phenyl]-3-quinolinecarbonitrile IUPAC Name: 4-[3-chloro-4-(1-methylimidazol-2-yl)sulfanylanilino]-6-methoxy-7-[4-(morpholin-4-ylmethyl)phenyl]quinoline-3-carbonitrile Traditional Name: 4-[3-chloro-4-[(1-methylimidazol-2-yl)thio]anilino]-6-methoxy-7-[4-(morpholinomethyl)phenyl]quinoline-3-carbonitrile Formula: C32H29ClN6O2S MolecularWeight: 597.12966

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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)CN6CCOCC6)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)CN6CCOCC6)C#N)Cl

InChI

InChI=1S/C32H29ClN6O2S/c1-38-10-9-35-32(38)42-30-8-7-24(15-27(30)33)37-31-23(18-34)19-36-28-16-25(29(40-2)17-26(28)31)22-5-3-21(4-6-22)20-39-11-13-41-14-12-39/h3-10,15-17,19H,11-14,20H2,1-2H3,(H,36,37)