4-(4-bromanylpyrazol-1-yl)-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide

Systemtic Name: 4-(4-bromanylpyrazol-1-yl)-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-4-(4-bromopyrazol-1-yl)benzamide CAS Name: 4-(4-bromo-1-pyrazolyl)-N-[1-(phenylmethyl)-3-pyrrolidinyl]benzamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-4-(4-bromopyrazol-1-yl)benzamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-4-(4-bromopyrazol-1-yl)benzamide Formula: C21H21BrN4O MolecularWeight: 425.32164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC1NC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br)CC4=CC=CC=C4

InChI

InChI=1S/C21H21BrN4O/c22-18-12-23-26(14-18)20-8-6-17(7-9-20)21(27)24-19-10-11-25(15-19)13-16-4-2-1-3-5-16/h1-9,12,14,19H,10-11,13,15H2,(H,24,27)