5-azanyl-4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)-1-phenyl-2H-pyrrol-3-one

Systemtic Name: 5-azanyl-4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)-1-phenyl-2H-pyrrol-3-one Openeye Name: 5-amino-4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)-1-phenyl-2H-pyrrol-3-one CAS Name: 5-amino-4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)-1-phenyl-2H-pyrrol-3-one IUPAC Name: 5-amino-4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)-1-phenyl-2H-pyrrol-3-one Traditional Name: 5-amino-4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)-1-phenyl-2-pyrrolin-3-one Formula: C18H16N3OS+ MolecularWeight: 322.40414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC2=CC=CC=C21)C3=C(N(CC3=O)C4=CC=CC=C4)N

Isomeric SMILES

C[N+]1=C(SC2=CC=CC=C21)C3=C(N(CC3=O)C4=CC=CC=C4)N

InChI

InChI=1S/C18H15N3OS/c1-20-13-9-5-6-10-15(13)23-18(20)16-14(22)11-21(17(16)19)12-7-3-2-4-8-12/h2-10,19H,11H2,1H3/p+1