3-(2,1,3-benzothiadiazol-5-yl)-5-(4-methoxyphenyl)-4-(2-methylpropyl)-5-oxidanyl-furan-2-one

Systemtic Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-(4-methoxyphenyl)-4-(2-methylpropyl)-5-oxidanyl-furan-2-one Openeye Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-hydroxy-4-isobutyl-5-(4-methoxyphenyl)furan-2-one CAS Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-4-(2-methylpropyl)-2-furanone IUPAC Name: 3-(2,1,3-benzothiadiazol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-4-(2-methylpropyl)furan-2-one Traditional Name: 5-hydroxy-4-isobutyl-5-(4-methoxyphenyl)-3-piazthiol-5-yl-furan-2-one Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=O)OC1(C2=CC=C(C=C2)OC)O)C3=CC4=NSN=C4C=C3

Isomeric SMILES

CC(C)CC1=C(C(=O)OC1(C2=CC=C(C=C2)OC)O)C3=CC4=NSN=C4C=C3

InChI

InChI=1S/C21H20N2O4S/c1-12(2)10-16-19(13-4-9-17-18(11-13)23-28-22-17)20(24)27-21(16,25)14-5-7-15(26-3)8-6-14/h4-9,11-12,25H,10H2,1-3H3