4-[2-azanyl-5-(3-chlorophenyl)pyrimidin-4-yl]-N-methyl-N-(phenylmethyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-azanyl-5-(3-chlorophenyl)pyrimidin-4-yl]-N-methyl-N-(phenylmethyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-amino-5-(3-chlorophenyl)pyrimidin-4-yl]-N-benzyl-N-methyl-1H-pyrrole-2-carboxamide CAS Name: 4-[2-amino-5-(3-chlorophenyl)-4-pyrimidinyl]-N-methyl-N-(phenylmethyl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-amino-5-(3-chlorophenyl)pyrimidin-4-yl]-N-benzyl-N-methyl-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-amino-5-(3-chlorophenyl)pyrimidin-4-yl]-N-benzyl-N-methyl-1H-pyrrole-2-carboxamide Formula: C23H20ClN5O MolecularWeight: 417.8908

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=CC(=CN2)C3=NC(=NC=C3C4=CC(=CC=C4)Cl)N

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=CC(=CN2)C3=NC(=NC=C3C4=CC(=CC=C4)Cl)N

InChI

InChI=1S/C23H20ClN5O/c1-29(14-15-6-3-2-4-7-15)22(30)20-11-17(12-26-20)21-19(13-27-23(25)28-21)16-8-5-9-18(24)10-16/h2-13,26H,14H2,1H3,(H2,25,27,28)