[1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-4-yl]-bis(prop-2-enyl)azanium

Systemtic Name: [1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-4-yl]-bis(prop-2-enyl)azanium Openeye Name: diallyl-[1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-4-piperidyl]ammonium CAS Name: [1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-4-piperidinyl]-bis(prop-2-enyl)ammonium IUPAC Name: [1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidin-4-yl]-bis(prop-2-enyl)azanium Traditional Name: diallyl-[1-(7-mesyl-4-methyl-quinazolin-2-yl)-4-piperidyl]ammonium Formula: C21H29N4O2S+ MolecularWeight: 401.54556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)[NH+](CC=C)CC=C

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)[NH+](CC=C)CC=C

InChI

InChI=1S/C21H28N4O2S/c1-5-11-24(12-6-2)17-9-13-25(14-10-17)21-22-16(3)19-8-7-18(28(4,26)27)15-20(19)23-21/h5-8,15,17H,1-2,9-14H2,3-4H3/p+1