2-[[(4S)-4-cyclopropyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[(4S)-4-cyclopropyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[(4S)-4-cyclopropyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[(4S)-4-cyclopropyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[(4S)-4-cyclopropyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[(4S)-4-cyclopropyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium-5-yl]methyl]-1H-quinazolin-4-one Formula: C19H20N3OS+ MolecularWeight: 338.4466

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2C3=C(CC[NH+]2CC4=NC(=O)C5=CC=CC=C5N4)SC=C3

Isomeric SMILES

C1CC1[C@H]2C3=C(CC[NH+]2CC4=NC(=O)C5=CC=CC=C5N4)SC=C3

InChI

InChI=1S/C19H19N3OS/c23-19-13-3-1-2-4-15(13)20-17(21-19)11-22-9-7-16-14(8-10-24-16)18(22)12-5-6-12/h1-4,8,10,12,18H,5-7,9,11H2,(H,20,21,23)/p+1/t18-/m0/s1