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

Systemtic Name: [1-(3-chloranyl-4-methyl-phenyl)-1,2,3-triazol-4-yl]-[4-(4-methylpiperazin-1-yl)phenyl]methanone Openeye Name: [1-(3-chloro-4-methyl-phenyl)triazol-4-yl]-[4-(4-methylpiperazin-1-yl)phenyl]methanone CAS Name: [1-(3-chloro-4-methylphenyl)-4-triazolyl]-[4-(4-methyl-1-piperazinyl)phenyl]methanone IUPAC Name: [1-(3-chloro-4-methylphenyl)triazol-4-yl]-[4-(4-methylpiperazin-1-yl)phenyl]methanone Traditional Name: [1-(3-chloro-4-methyl-phenyl)triazol-4-yl]-[4-(4-methylpiperazino)phenyl]methanone Formula: C21H22ClN5O MolecularWeight: 395.88528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=C(N=N2)C(=O)C3=CC=C(C=C3)N4CCN(CC4)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C(N=N2)C(=O)C3=CC=C(C=C3)N4CCN(CC4)C)Cl

InChI

InChI=1S/C21H22ClN5O/c1-15-3-6-18(13-19(15)22)27-14-20(23-24-27)21(28)16-4-7-17(8-5-16)26-11-9-25(2)10-12-26/h3-8,13-14H,9-12H2,1-2H3