5-bromanyl-N-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]-1H-indole-2-carboxamide

Systemtic Name: 5-bromanyl-N-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]-1H-indole-2-carboxamide Openeye Name: N-[1-(2-benzyloxyethyl)pyrazol-4-yl]-5-bromo-1H-indole-2-carboxamide CAS Name: 5-bromo-N-[1-(2-phenylmethoxyethyl)-4-pyrazolyl]-1H-indole-2-carboxamide IUPAC Name: 5-bromo-N-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]-1H-indole-2-carboxamide Traditional Name: N-[1-(2-benzoxyethyl)pyrazol-4-yl]-5-bromo-1H-indole-2-carboxamide Formula: C21H19BrN4O2 MolecularWeight: 439.30516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCN2C=C(C=N2)NC(=O)C3=CC4=C(N3)C=CC(=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)COCCN2C=C(C=N2)NC(=O)C3=CC4=C(N3)C=CC(=C4)Br

InChI

InChI=1S/C21H19BrN4O2/c22-17-6-7-19-16(10-17)11-20(25-19)21(27)24-18-12-23-26(13-18)8-9-28-14-15-4-2-1-3-5-15/h1-7,10-13,25H,8-9,14H2,(H,24,27)