3-cyclohexyl-9-methyl-5-(3-methylpiperazin-1-yl)-[1,2,4]triazolo[4,3-c]quinazoline

Systemtic Name: 3-cyclohexyl-9-methyl-5-(3-methylpiperazin-1-yl)-[1,2,4]triazolo[4,3-c]quinazoline Openeye Name: 3-cyclohexyl-9-methyl-5-(3-methylpiperazin-1-yl)-[1,2,4]triazolo[4,3-c]quinazoline CAS Name: 3-cyclohexyl-9-methyl-5-(3-methyl-1-piperazinyl)-[1,2,4]triazolo[4,3-c]quinazoline IUPAC Name: 3-cyclohexyl-9-methyl-5-(3-methylpiperazin-1-yl)-[1,2,4]triazolo[4,3-c]quinazoline Traditional Name: 3-cyclohexyl-9-methyl-5-(3-methylpiperazino)-[1,2,4]triazolo[4,3-c]quinazoline Formula: C21H28N6 MolecularWeight: 364.48722

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=NC3=C(C=C(C=C3)C)C4=NN=C(N42)C5CCCCC5

Isomeric SMILES

CC1CN(CCN1)C2=NC3=C(C=C(C=C3)C)C4=NN=C(N42)C5CCCCC5

InChI

InChI=1S/C21H28N6/c1-14-8-9-18-17(12-14)20-25-24-19(16-6-4-3-5-7-16)27(20)21(23-18)26-11-10-22-15(2)13-26/h8-9,12,15-16,22H,3-7,10-11,13H2,1-2H3