(6-ethoxycarbonyl-7-methyl-3-oxidanyl-5-phenyl-2,5-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-phenyl-propan-2-yl-azanium

Systemtic Name: (6-ethoxycarbonyl-7-methyl-3-oxidanyl-5-phenyl-2,5-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-phenyl-propan-2-yl-azanium Openeye Name: (6-ethoxycarbonyl-3-hydroxy-7-methyl-5-phenyl-2,5-dihydrothiazolo[3,2-a]pyrimidin-3-yl)-isopropyl-phenyl-ammonium CAS Name: (6-ethoxycarbonyl-3-hydroxy-7-methyl-5-phenyl-2,5-dihydrothiazolo[3,2-a]pyrimidin-3-yl)-phenyl-propan-2-ylammonium IUPAC Name: (6-ethoxycarbonyl-3-hydroxy-7-methyl-5-phenyl-2,5-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-phenyl-propan-2-ylazanium Traditional Name: (6-carbethoxy-3-hydroxy-7-methyl-5-phenyl-2,5-dihydrothiazolo[3,2-a]pyrimidin-3-yl)-isopropyl-phenyl-ammonium Formula: C25H30N3O3S+ MolecularWeight: 452.589

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(CS2)([NH+](C4=CC=CC=C4)C(C)C)O)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(CS2)([NH+](C4=CC=CC=C4)C(C)C)O)C

InChI

InChI=1S/C25H29N3O3S/c1-5-31-23(29)21-18(4)26-24-28(22(21)19-12-8-6-9-13-19)25(30,16-32-24)27(17(2)3)20-14-10-7-11-15-20/h6-15,17,22,30H,5,16H2,1-4H3/p+1