2-(4-cyclobutylcarbonyl-1,4-diazepan-1-yl)-8-methyl-quinoline-3-carbonitrile

Systemtic Name: 2-(4-cyclobutylcarbonyl-1,4-diazepan-1-yl)-8-methyl-quinoline-3-carbonitrile Openeye Name: 2-[4-(cyclobutanecarbonyl)-1,4-diazepan-1-yl]-8-methyl-quinoline-3-carbonitrile CAS Name: 2-[4-[cyclobutyl(oxo)methyl]-1,4-diazepan-1-yl]-8-methyl-3-quinolinecarbonitrile IUPAC Name: 2-[4-(cyclobutanecarbonyl)-1,4-diazepan-1-yl]-8-methylquinoline-3-carbonitrile Traditional Name: 2-[4-(cyclobutanecarbonyl)-1,4-diazepan-1-yl]-8-methyl-quinoline-3-carbonitrile Formula: C21H24N4O MolecularWeight: 348.44146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C(=C2)C#N)N3CCCN(CC3)C(=O)C4CCC4

Isomeric SMILES

CC1=CC=CC2=C1N=C(C(=C2)C#N)N3CCCN(CC3)C(=O)C4CCC4

InChI

InChI=1S/C21H24N4O/c1-15-5-2-8-17-13-18(14-22)20(23-19(15)17)24-9-4-10-25(12-11-24)21(26)16-6-3-7-16/h2,5,8,13,16H,3-4,6-7,9-12H2,1H3