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

Systemtic Name: 4,6-dimethyl-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-1H-indole-2-carboxamide Openeye Name: 4,6-dimethyl-N-[4-(3-oxopiperazin-1-yl)phenyl]-1H-indole-2-carboxamide CAS Name: 4,6-dimethyl-N-[4-(3-oxo-1-piperazinyl)phenyl]-1H-indole-2-carboxamide IUPAC Name: 4,6-dimethyl-N-[4-(3-oxopiperazin-1-yl)phenyl]-1H-indole-2-carboxamide Traditional Name: N-[4-(3-ketopiperazino)phenyl]-4,6-dimethyl-1H-indole-2-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NC2=C1)C(=O)NC3=CC=C(C=C3)N4CCNC(=O)C4)C

Isomeric SMILES

CC1=CC(=C2C=C(NC2=C1)C(=O)NC3=CC=C(C=C3)N4CCNC(=O)C4)C

InChI

InChI=1S/C21H22N4O2/c1-13-9-14(2)17-11-19(24-18(17)10-13)21(27)23-15-3-5-16(6-4-15)25-8-7-22-20(26)12-25/h3-6,9-11,24H,7-8,12H2,1-2H3,(H,22,26)(H,23,27)