7,7-dimethyl-1-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione

Systemtic Name: 7,7-dimethyl-1-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione Openeye Name: 7,7-dimethyl-1-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione CAS Name: 7,7-dimethyl-1-[3-(4-morpholin-4-iumyl)propyl]-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione IUPAC Name: 7,7-dimethyl-1-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione Traditional Name: 7,7-dimethyl-1-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione Formula: C22H30N3O2S+ MolecularWeight: 400.5575

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(CO1)C(=S)N=C(N2CCC[NH+]3CCOCC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=C(CO1)C(=S)N=C(N2CCC[NH+]3CCOCC3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H29N3O2S/c1-22(2)15-19-18(16-27-22)21(28)23-20(17-7-4-3-5-8-17)25(19)10-6-9-24-11-13-26-14-12-24/h3-5,7-8H,6,9-16H2,1-2H3/p+1