(E)-1-[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-(2-bromophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-(2-bromophenyl)prop-2-en-1-one Openeye Name: (E)-1-[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-(2-bromophenyl)prop-2-en-1-one CAS Name: (E)-1-[2-(1H-benzimidazol-2-yl)-1-pyrrolidinyl]-3-(2-bromophenyl)-2-propen-1-one IUPAC Name: (E)-1-[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-(2-bromophenyl)prop-2-en-1-one Traditional Name: (E)-1-[2-(1H-benzimidazol-2-yl)pyrrolidino]-3-(2-bromophenyl)prop-2-en-1-one Formula: C20H18BrN3O MolecularWeight: 396.28042

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C=CC2=CC=CC=C2Br)C3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CC(N(C1)C(=O)/C=C/C2=CC=CC=C2Br)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H18BrN3O/c21-15-7-2-1-6-14(15)11-12-19(25)24-13-5-10-18(24)20-22-16-8-3-4-9-17(16)23-20/h1-4,6-9,11-12,18H,5,10,13H2,(H,22,23)/b12-11+