4,6-dimethyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1H-indole-2-carboxamide

Systemtic Name: 4,6-dimethyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1H-indole-2-carboxamide Openeye Name: 4,6-dimethyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1H-indole-2-carboxamide CAS Name: 4,6-dimethyl-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-1H-indole-2-carboxamide IUPAC Name: 4,6-dimethyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1H-indole-2-carboxamide Traditional Name: N-[3-(isobutyrylamino)benzyl]-4,6-dimethyl-1H-indole-2-carboxamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NC2=C1)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C)C

Isomeric SMILES

CC1=CC(=C2C=C(NC2=C1)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C)C

InChI

InChI=1S/C22H25N3O2/c1-13(2)21(26)24-17-7-5-6-16(10-17)12-23-22(27)20-11-18-15(4)8-14(3)9-19(18)25-20/h5-11,13,25H,12H2,1-4H3,(H,23,27)(H,24,26)