4-[[2-(4-cyanophenyl)-2-(3-methylimidazol-4-yl)-2-oxidanyl-ethyl]-methyl-amino]-3-(3-methoxyphenyl)benzenecarbonitrile

Systemtic Name: 4-[[2-(4-cyanophenyl)-2-(3-methylimidazol-4-yl)-2-oxidanyl-ethyl]-methyl-amino]-3-(3-methoxyphenyl)benzenecarbonitrile Openeye Name: 4-[[2-(4-cyanophenyl)-2-hydroxy-2-(3-methylimidazol-4-yl)ethyl]-methyl-amino]-3-(3-methoxyphenyl)benzonitrile CAS Name: 4-[[2-(4-cyanophenyl)-2-hydroxy-2-(3-methyl-4-imidazolyl)ethyl]-methylamino]-3-(3-methoxyphenyl)benzonitrile IUPAC Name: 4-[[2-(4-cyanophenyl)-2-hydroxy-2-(3-methylimidazol-4-yl)ethyl]-methylamino]-3-(3-methoxyphenyl)benzonitrile Traditional Name: 4-[[2-(4-cyanophenyl)-2-hydroxy-2-(3-methylimidazol-4-yl)ethyl]-methyl-amino]-3-(3-methoxyphenyl)benzonitrile Formula: C28H25N5O2 MolecularWeight: 463.5304

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(CN(C)C2=C(C=C(C=C2)C#N)C3=CC(=CC=C3)OC)(C4=CC=C(C=C4)C#N)O

Isomeric SMILES

CN1C=NC=C1C(CN(C)C2=C(C=C(C=C2)C#N)C3=CC(=CC=C3)OC)(C4=CC=C(C=C4)C#N)O

InChI

InChI=1S/C28H25N5O2/c1-32(26-12-9-21(16-30)13-25(26)22-5-4-6-24(14-22)35-3)18-28(34,27-17-31-19-33(27)2)23-10-7-20(15-29)8-11-23/h4-14,17,19,34H,18H2,1-3H3