5-cyclopropyl-1-(8-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide

Systemtic Name: 5-cyclopropyl-1-(8-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide Openeye Name: 5-cyclopropyl-1-(8-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide CAS Name: 5-cyclopropyl-1-(8-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N-[2-(4-morpholin-4-iumyl)ethyl]-4-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-1-(8-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide Traditional Name: 5-cyclopropyl-1-(8-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide Formula: C26H31N6O3+ MolecularWeight: 475.56274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=NC(=NC=C3CC2)N4C(=C(C=N4)C(=O)NCC[NH+]5CCOCC5)C6CC6

Isomeric SMILES

COC1=CC2=C(C=C1)C3=NC(=NC=C3CC2)N4C(=C(C=N4)C(=O)NCC[NH+]5CCOCC5)C6CC6

InChI

InChI=1S/C26H30N6O3/c1-34-20-6-7-21-18(14-20)4-5-19-15-28-26(30-23(19)21)32-24(17-2-3-17)22(16-29-32)25(33)27-8-9-31-10-12-35-13-11-31/h6-7,14-17H,2-5,8-13H2,1H3,(H,27,33)/p+1