N-[4-[[4-(1H-indazol-3-ylcarbonyl)-1,4-diazepan-1-yl]methyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-(1H-indazol-3-ylcarbonyl)-1,4-diazepan-1-yl]methyl]phenyl]ethanamide Openeye Name: N-[4-[[4-(1H-indazole-3-carbonyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide CAS Name: N-[4-[[4-[1H-indazol-3-yl(oxo)methyl]-1,4-diazepan-1-yl]methyl]phenyl]acetamide IUPAC Name: N-[4-[[4-(1H-indazole-3-carbonyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide Traditional Name: N-[4-[[4-(1H-indazole-3-carbonyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=NNC4=CC=CC=C43

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=NNC4=CC=CC=C43

InChI

InChI=1S/C22H25N5O2/c1-16(28)23-18-9-7-17(8-10-18)15-26-11-4-12-27(14-13-26)22(29)21-19-5-2-3-6-20(19)24-25-21/h2-3,5-10H,4,11-15H2,1H3,(H,23,28)(H,24,25)