N-[2-(5-bromanyl-2,3-dihydroindol-1-yl)-5-methyl-phenyl]-4-methyl-piperazine-1-carboxamide

Systemtic Name: N-[2-(5-bromanyl-2,3-dihydroindol-1-yl)-5-methyl-phenyl]-4-methyl-piperazine-1-carboxamide Openeye Name: N-[2-(5-bromoindolin-1-yl)-5-methyl-phenyl]-4-methyl-piperazine-1-carboxamide CAS Name: N-[2-(5-bromo-2,3-dihydroindol-1-yl)-5-methylphenyl]-4-methyl-1-piperazinecarboxamide IUPAC Name: N-[2-(5-bromo-2,3-dihydroindol-1-yl)-5-methylphenyl]-4-methylpiperazine-1-carboxamide Traditional Name: N-[2-(5-bromoindolin-1-yl)-5-methyl-phenyl]-4-methyl-piperazine-1-carboxamide Formula: C21H25BrN4O MolecularWeight: 429.3534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCC3=C2C=CC(=C3)Br)NC(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCC3=C2C=CC(=C3)Br)NC(=O)N4CCN(CC4)C

InChI

InChI=1S/C21H25BrN4O/c1-15-3-5-20(26-8-7-16-14-17(22)4-6-19(16)26)18(13-15)23-21(27)25-11-9-24(2)10-12-25/h3-6,13-14H,7-12H2,1-2H3,(H,23,27)