(7-chloranyl-2-methyl-quinolin-4-yl)-[4-(1H-1,2,4-triazol-5-ylcarbonyl)piperazin-1-yl]methanone

Systemtic Name: (7-chloranyl-2-methyl-quinolin-4-yl)-[4-(1H-1,2,4-triazol-5-ylcarbonyl)piperazin-1-yl]methanone Openeye Name: (7-chloro-2-methyl-4-quinolyl)-[4-(1H-1,2,4-triazole-5-carbonyl)piperazin-1-yl]methanone CAS Name: (7-chloro-2-methyl-4-quinolinyl)-[4-[oxo(1H-1,2,4-triazol-5-yl)methyl]-1-piperazinyl]methanone IUPAC Name: (7-chloro-2-methylquinolin-4-yl)-[4-(1H-1,2,4-triazole-5-carbonyl)piperazin-1-yl]methanone Traditional Name: (7-chloro-2-methyl-4-quinolyl)-[4-(1H-1,2,4-triazole-5-carbonyl)piperazino]methanone Formula: C18H17ClN6O2 MolecularWeight: 384.81958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)Cl)C(=C1)C(=O)N3CCN(CC3)C(=O)C4=NC=NN4

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)Cl)C(=C1)C(=O)N3CCN(CC3)C(=O)C4=NC=NN4

InChI

InChI=1S/C18H17ClN6O2/c1-11-8-14(13-3-2-12(19)9-15(13)22-11)17(26)24-4-6-25(7-5-24)18(27)16-20-10-21-23-16/h2-3,8-10H,4-7H2,1H3,(H,20,21,23)