N-[[4-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)pyrimidin-2-yl]methyl]-4-pyrrol-1-yl-benzamide

Systemtic Name: N-[[4-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)pyrimidin-2-yl]methyl]-4-pyrrol-1-yl-benzamide Openeye Name: N-[[4-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)pyrimidin-2-yl]methyl]-4-pyrrol-1-yl-benzamide CAS Name: N-[[4-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)-2-pyrimidinyl]methyl]-4-(1-pyrrolyl)benzamide IUPAC Name: N-[[4-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)pyrimidin-2-yl]methyl]-4-pyrrol-1-ylbenzamide Traditional Name: N-[[4-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)pyrimidin-2-yl]methyl]-4-pyrrol-1-yl-benzamide Formula: C29H22Cl2N4O2 MolecularWeight: 529.41658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(N=C2C3=C(C=C(C=C3)Cl)Cl)CNC(=O)C4=CC=C(C=C4)N5C=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(N=C2C3=C(C=C(C=C3)Cl)Cl)CNC(=O)C4=CC=C(C=C4)N5C=CC=C5

InChI

InChI=1S/C29H22Cl2N4O2/c1-37-23-11-6-19(7-12-23)25-17-32-27(34-28(25)24-13-8-21(30)16-26(24)31)18-33-29(36)20-4-9-22(10-5-20)35-14-2-3-15-35/h2-17H,18H2,1H3,(H,33,36)