(4S)-5-azanyl-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-morpholin-4-yl-2,4-dihydropyrrol-1-ium-3-one

Systemtic Name: (4S)-5-azanyl-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-morpholin-4-yl-2,4-dihydropyrrol-1-ium-3-one Openeye Name: (4S)-5-amino-4-[4-(4-methoxyphenyl)thiazol-2-yl]-1-morpholino-2,4-dihydropyrrol-1-ium-3-one CAS Name: (4S)-5-amino-4-[4-(4-methoxyphenyl)-2-thiazolyl]-1-(4-morpholinyl)-2,4-dihydropyrrol-1-ium-3-one IUPAC Name: (4S)-5-amino-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-morpholin-4-yl-2,4-dihydropyrrol-1-ium-3-one Traditional Name: (4S)-5-amino-4-[4-(4-methoxyphenyl)thiazol-2-yl]-1-morpholino-1-pyrrolin-1-ium-3-one Formula: C18H21N4O3S+ MolecularWeight: 373.44934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)C3C(=O)C[N+](=C3N)N4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)[C@@H]3C(=O)C[N+](=C3N)N4CCOCC4

InChI

InChI=1S/C18H20N4O3S/c1-24-13-4-2-12(3-5-13)14-11-26-18(20-14)16-15(23)10-22(17(16)19)21-6-8-25-9-7-21/h2-5,11,16,19H,6-10H2,1H3/p+1/t16-/m1/s1