1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide Openeye Name: 1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide CAS Name: 1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]-4-pyrazolecarboxamide IUPAC Name: 1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide Traditional Name: 1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide Formula: C24H29N6O3+ MolecularWeight: 449.52546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=C3CCC4=C(C3=N2)C=C(C=C4)OC)C(=O)NCC[NH+]5CCOCC5

Isomeric SMILES

CC1=C(C=NN1C2=NC=C3CCC4=C(C3=N2)C=C(C=C4)OC)C(=O)NCC[NH+]5CCOCC5

InChI

InChI=1S/C24H28N6O3/c1-16-21(23(31)25-7-8-29-9-11-33-12-10-29)15-27-30(16)24-26-14-18-4-3-17-5-6-19(32-2)13-20(17)22(18)28-24/h5-6,13-15H,3-4,7-12H2,1-2H3,(H,25,31)/p+1