N-(2,6-diethylphenyl)-2-[4-(1H-indazol-3-ylcarbonyl)-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[4-(1H-indazol-3-ylcarbonyl)-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-[4-(1H-indazole-3-carbonyl)-1,4-diazepan-1-yl]acetamide CAS Name: N-(2,6-diethylphenyl)-2-[4-[1H-indazol-3-yl(oxo)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-[4-(1H-indazole-3-carbonyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-(2,6-diethylphenyl)-2-[4-(1H-indazole-3-carbonyl)-1,4-diazepan-1-yl]acetamide Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)C(=O)C3=NNC4=CC=CC=C43

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CN2CCCN(CC2)C(=O)C3=NNC4=CC=CC=C43

InChI

InChI=1S/C25H31N5O2/c1-3-18-9-7-10-19(4-2)23(18)26-22(31)17-29-13-8-14-30(16-15-29)25(32)24-20-11-5-6-12-21(20)27-28-24/h5-7,9-12H,3-4,8,13-17H2,1-2H3,(H,26,31)(H,27,28)