2-(4-cyclobutylcarbonyl-1,4-diazepan-1-yl)-7-methyl-quinoline-3-carbonitrile

Systemtic Name: 2-(4-cyclobutylcarbonyl-1,4-diazepan-1-yl)-7-methyl-quinoline-3-carbonitrile Openeye Name: 2-[4-(cyclobutanecarbonyl)-1,4-diazepan-1-yl]-7-methyl-quinoline-3-carbonitrile CAS Name: 2-[4-[cyclobutyl(oxo)methyl]-1,4-diazepan-1-yl]-7-methyl-3-quinolinecarbonitrile IUPAC Name: 2-[4-(cyclobutanecarbonyl)-1,4-diazepan-1-yl]-7-methylquinoline-3-carbonitrile Traditional Name: 2-[4-(cyclobutanecarbonyl)-1,4-diazepan-1-yl]-7-methyl-quinoline-3-carbonitrile Formula: C21H24N4O MolecularWeight: 348.44146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)N3CCCN(CC3)C(=O)C4CCC4)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)N3CCCN(CC3)C(=O)C4CCC4)C#N

InChI

InChI=1S/C21H24N4O/c1-15-6-7-17-13-18(14-22)20(23-19(17)12-15)24-8-3-9-25(11-10-24)21(26)16-4-2-5-16/h6-7,12-13,16H,2-5,8-11H2,1H3