N-[4-(aminomethyl)phenyl]-5-bromanyl-N-[1-(methylamino)pentan-2-yl]-1H-indole-2-carboxamide

Systemtic Name: N-[4-(aminomethyl)phenyl]-5-bromanyl-N-[1-(methylamino)pentan-2-yl]-1H-indole-2-carboxamide Openeye Name: N-[4-(aminomethyl)phenyl]-5-bromo-N-[1-(methylaminomethyl)butyl]-1H-indole-2-carboxamide CAS Name: N-[4-(aminomethyl)phenyl]-5-bromo-N-[1-(methylamino)pentan-2-yl]-1H-indole-2-carboxamide IUPAC Name: N-[4-(aminomethyl)phenyl]-5-bromo-N-[1-(methylamino)pentan-2-yl]-1H-indole-2-carboxamide Traditional Name: N-[4-(aminomethyl)phenyl]-5-bromo-N-[1-(methylaminomethyl)butyl]-1H-indole-2-carboxamide Formula: C22H27BrN4O MolecularWeight: 443.37998

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CNC)N(C1=CC=C(C=C1)CN)C(=O)C2=CC3=C(N2)C=CC(=C3)Br

Isomeric SMILES

CCCC(CNC)N(C1=CC=C(C=C1)CN)C(=O)C2=CC3=C(N2)C=CC(=C3)Br

InChI

InChI=1S/C22H27BrN4O/c1-3-4-19(14-25-2)27(18-8-5-15(13-24)6-9-18)22(28)21-12-16-11-17(23)7-10-20(16)26-21/h5-12,19,25-26H,3-4,13-14,24H2,1-2H3