7-chloranyl-4-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 7-chloranyl-4-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-[3-(4-benzhydrylpiperazin-1-yl)propyl]-7-chloro-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 7-chloro-4-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 4-[3-(4-benzhydrylpiperazin-1-yl)propyl]-7-chloro-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-[3-(4-benzhydrylpiperazino)propyl]-7-chloro-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C30H31ClN6O MolecularWeight: 527.05974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C2N1C3=C(C=C(C=C3)Cl)C(=O)N2CCCN4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=NN=C2N1C3=C(C=C(C=C3)Cl)C(=O)N2CCCN4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C30H31ClN6O/c1-22-32-33-30-36(29(38)26-21-25(31)13-14-27(26)37(22)30)16-8-15-34-17-19-35(20-18-34)28(23-9-4-2-5-10-23)24-11-6-3-7-12-24/h2-7,9-14,21,28H,8,15-20H2,1H3