2-[[5-cyclopropyl-1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)pyrazol-4-yl]carbonyl-methyl-amino]ethyl-diethyl-azanium

Systemtic Name: 2-[[5-cyclopropyl-1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)pyrazol-4-yl]carbonyl-methyl-amino]ethyl-diethyl-azanium Openeye Name: 2-[[5-cyclopropyl-1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)pyrazole-4-carbonyl]-methyl-amino]ethyl-diethyl-ammonium CAS Name: 2-[[[5-cyclopropyl-1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-4-pyrazolyl]-oxomethyl]-methylamino]ethyl-diethylammonium IUPAC Name: 2-[[5-cyclopropyl-1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)pyrazole-4-carbonyl]-methylamino]ethyl-diethylazanium Traditional Name: 2-[[5-cyclopropyl-1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)pyrazole-4-carbonyl]-methyl-amino]ethyl-diethyl-ammonium Formula: C27H35N6O2+ MolecularWeight: 475.6058

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C)C(=O)C1=C(N(N=C1)C2=NC=C3CCC4=C(C3=N2)C=C(C=C4)OC)C5CC5

Isomeric SMILES

CC[NH+](CC)CCN(C)C(=O)C1=C(N(N=C1)C2=NC=C3CCC4=C(C3=N2)C=C(C=C4)OC)C5CC5

InChI

InChI=1S/C27H34N6O2/c1-5-32(6-2)14-13-31(3)26(34)23-17-29-33(25(23)19-8-9-19)27-28-16-20-10-7-18-11-12-21(35-4)15-22(18)24(20)30-27/h11-12,15-17,19H,5-10,13-14H2,1-4H3/p+1