N-[2-(2-bromophenyl)ethyl]-4-chloranyl-1-pyrimidin-2-yl-indole-3-carboxamide

Systemtic Name: N-[2-(2-bromophenyl)ethyl]-4-chloranyl-1-pyrimidin-2-yl-indole-3-carboxamide Openeye Name: N-[2-(2-bromophenyl)ethyl]-4-chloro-1-pyrimidin-2-yl-indole-3-carboxamide CAS Name: N-[2-(2-bromophenyl)ethyl]-4-chloro-1-(2-pyrimidinyl)-3-indolecarboxamide IUPAC Name: N-[2-(2-bromophenyl)ethyl]-4-chloro-1-pyrimidin-2-ylindole-3-carboxamide Traditional Name: N-[2-(2-bromophenyl)ethyl]-4-chloro-1-(2-pyrimidyl)indole-3-carboxamide Formula: C21H16BrClN4O MolecularWeight: 455.73494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCNC(=O)C2=CN(C3=C2C(=CC=C3)Cl)C4=NC=CC=N4)Br

Isomeric SMILES

C1=CC=C(C(=C1)CCNC(=O)C2=CN(C3=C2C(=CC=C3)Cl)C4=NC=CC=N4)Br

InChI

InChI=1S/C21H16BrClN4O/c22-16-6-2-1-5-14(16)9-12-24-20(28)15-13-27(21-25-10-4-11-26-21)18-8-3-7-17(23)19(15)18/h1-8,10-11,13H,9,12H2,(H,24,28)