[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(1-cycloheptyl-1,2,3-triazol-4-yl)methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(1-cycloheptyl-1,2,3-triazol-4-yl)methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-(1-cycloheptyltriazol-4-yl)methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-(1-cycloheptyl-4-triazolyl)methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-(1-cycloheptyltriazol-4-yl)methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-(1-cycloheptyltriazol-4-yl)methanone Formula: C21H28ClN5O MolecularWeight: 401.93292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CN(N=N3)C4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CN(N=N3)C4CCCCCC4

InChI

InChI=1S/C21H28ClN5O/c1-16-8-9-17(22)14-20(16)25-10-12-26(13-11-25)21(28)19-15-27(24-23-19)18-6-4-2-3-5-7-18/h8-9,14-15,18H,2-7,10-13H2,1H3