1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-2-(4-nitrophenyl)-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-2-(4-nitrophenyl)-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-2-(4-nitrophenyl)-2H-pyrrol-5-one CAS Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2-(4-nitrophenyl)-2H-pyrrol-5-one IUPAC Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-(4-nitrophenyl)-2H-pyrrol-5-one Traditional Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-hydroxy-4-(7-methoxybenzofuran-2-carbonyl)-5-(4-nitrophenyl)-3-pyrrolin-2-one Formula: C29H21N3O7S MolecularWeight: 555.55794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C3=O)O)C(=O)C4=CC5=C(O4)C(=CC=C5)OC)C6=CC=C(C=C6)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C3=O)O)C(=O)C4=CC5=C(O4)C(=CC=C5)OC)C6=CC=C(C=C6)[N+](=O)[O-])C

InChI

InChI=1S/C29H21N3O7S/c1-14-11-15(2)23-21(12-14)40-29(30-23)31-24(16-7-9-18(10-8-16)32(36)37)22(26(34)28(31)35)25(33)20-13-17-5-4-6-19(38-3)27(17)39-20/h4-13,24,34H,1-3H3