(6,7-dimethoxy-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl-methyl-[(1R)-1-thiophen-2-ylethyl]azanium

Systemtic Name: (6,7-dimethoxy-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl-methyl-[(1R)-1-thiophen-2-ylethyl]azanium Openeye Name: (6,7-dimethoxy-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl-methyl-[(1R)-1-(2-thienyl)ethyl]ammonium CAS Name: [6,7-dimethoxy-4-(1-pyrrolidinyl)-2-quinazolinyl]methyl-methyl-[(1R)-1-thiophen-2-ylethyl]ammonium IUPAC Name: (6,7-dimethoxy-4-pyrrolidin-1-ylquinazolin-2-yl)methyl-methyl-[(1R)-1-thiophen-2-ylethyl]azanium Traditional Name: (6,7-dimethoxy-4-pyrrolidino-quinazolin-2-yl)methyl-methyl-[(1R)-1-(2-thienyl)ethyl]ammonium Formula: C22H29N4O2S+ MolecularWeight: 413.55626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)[NH+](C)CC2=NC3=CC(=C(C=C3C(=N2)N4CCCC4)OC)OC

Isomeric SMILES

C[C@H](C1=CC=CS1)[NH+](C)CC2=NC3=CC(=C(C=C3C(=N2)N4CCCC4)OC)OC

InChI

InChI=1S/C22H28N4O2S/c1-15(20-8-7-11-29-20)25(2)14-21-23-17-13-19(28-4)18(27-3)12-16(17)22(24-21)26-9-5-6-10-26/h7-8,11-13,15H,5-6,9-10,14H2,1-4H3/p+1/t15-/m1/s1