N-[3-chloranyl-4-(1-methylimidazol-2-yl)sulfanyl-phenyl]-5-(1-methylpiperidin-4-yl)oxy-quinazolin-4-amine

Systemtic Name: N-[3-chloranyl-4-(1-methylimidazol-2-yl)sulfanyl-phenyl]-5-(1-methylpiperidin-4-yl)oxy-quinazolin-4-amine Openeye Name: N-[3-chloro-4-(1-methylimidazol-2-yl)sulfanyl-phenyl]-5-[(1-methyl-4-piperidyl)oxy]quinazolin-4-amine CAS Name: N-[3-chloro-4-[(1-methyl-2-imidazolyl)thio]phenyl]-5-[(1-methyl-4-piperidinyl)oxy]-4-quinazolinamine IUPAC Name: N-[3-chloro-4-(1-methylimidazol-2-yl)sulfanylphenyl]-5-(1-methylpiperidin-4-yl)oxyquinazolin-4-amine Traditional Name: [3-chloro-4-[(1-methylimidazol-2-yl)thio]phenyl]-[5-[(1-methyl-4-piperidyl)oxy]quinazolin-4-yl]amine Formula: C24H25ClN6OS MolecularWeight: 481.0129

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)OC2=CC=CC3=C2C(=NC=N3)NC4=CC(=C(C=C4)SC5=NC=CN5C)Cl

Isomeric SMILES

CN1CCC(CC1)OC2=CC=CC3=C2C(=NC=N3)NC4=CC(=C(C=C4)SC5=NC=CN5C)Cl

InChI

InChI=1S/C24H25ClN6OS/c1-30-11-8-17(9-12-30)32-20-5-3-4-19-22(20)23(28-15-27-19)29-16-6-7-21(18(25)14-16)33-24-26-10-13-31(24)2/h3-7,10,13-15,17H,8-9,11-12H2,1-2H3,(H,27,28,29)