(2S)-2-(4-tert-butylphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-(5-methylfuran-2-yl)carbonyl-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: (2S)-2-(4-tert-butylphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-(5-methylfuran-2-yl)carbonyl-4-oxidanyl-2H-pyrrol-5-one Openeye Name: (2S)-2-(4-tert-butylphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2H-pyrrol-5-one CAS Name: (2S)-2-(4-tert-butylphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-hydroxy-3-[(5-methyl-2-furanyl)-oxomethyl]-2H-pyrrol-5-one IUPAC Name: (2S)-2-(4-tert-butylphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2H-pyrrol-5-one Traditional Name: (5S)-5-(4-tert-butylphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-hydroxy-4-(5-methyl-2-furoyl)-3-pyrrolin-2-one Formula: C29H28N2O4S MolecularWeight: 500.60862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC=C(O4)C)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N3[C@H](C(=C(C3=O)O)C(=O)C4=CC=C(O4)C)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C29H28N2O4S/c1-6-17-8-13-20-22(15-17)36-28(30-20)31-24(18-9-11-19(12-10-18)29(3,4)5)23(26(33)27(31)34)25(32)21-14-7-16(2)35-21/h7-15,24,33H,6H2,1-5H3/t24-/m0/s1