N4-(3-chloranyl-4-phenylmethoxy-phenyl)-5-[(E)-3-(2-methoxyethylamino)propoxyiminomethyl]pyrimidine-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-phenylmethoxy-phenyl)-5-[(E)-3-(2-methoxyethylamino)propoxyiminomethyl]pyrimidine-4,6-diamine Openeye Name: N4-(4-benzyloxy-3-chloro-phenyl)-5-[(E)-3-(2-methoxyethylamino)propoxyiminomethyl]pyrimidine-4,6-diamine CAS Name: N4-(3-chloro-4-phenylmethoxyphenyl)-5-[(E)-3-(2-methoxyethylamino)propoxyiminomethyl]pyrimidine-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-phenylmethoxyphenyl)-5-[(E)-3-(2-methoxyethylamino)propoxyiminomethyl]pyrimidine-4,6-diamine Traditional Name: 3-[(E)-[4-amino-6-(4-benzoxy-3-chloro-anilino)pyrimidin-5-yl]methyleneamino]oxypropyl-(2-methoxyethyl)amine Formula: C24H29ClN6O3 MolecularWeight: 484.97846

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Descriptors Computed from Structure

Canonical SMILES:

COCCNCCCON=CC1=C(N=CN=C1NC2=CC(=C(C=C2)OCC3=CC=CC=C3)Cl)N

Isomeric SMILES

COCCNCCCO/N=C/C1=C(N=CN=C1NC2=CC(=C(C=C2)OCC3=CC=CC=C3)Cl)N

InChI

InChI=1S/C24H29ClN6O3/c1-32-13-11-27-10-5-12-34-30-15-20-23(26)28-17-29-24(20)31-19-8-9-22(21(25)14-19)33-16-18-6-3-2-4-7-18/h2-4,6-9,14-15,17,27H,5,10-13,16H2,1H3,(H3,26,28,29,31)/b30-15+