3-(2,1,3-benzothiadiazol-5-yl)-4-(cyclohexylmethyl)-5-(3,4-diethylphenyl)-5-oxidanyl-furan-2-one

Systemtic Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-(cyclohexylmethyl)-5-(3,4-diethylphenyl)-5-oxidanyl-furan-2-one Openeye Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-(cyclohexylmethyl)-5-(3,4-diethylphenyl)-5-hydroxy-furan-2-one CAS Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-(cyclohexylmethyl)-5-(3,4-diethylphenyl)-5-hydroxy-2-furanone IUPAC Name: 3-(2,1,3-benzothiadiazol-5-yl)-4-(cyclohexylmethyl)-5-(3,4-diethylphenyl)-5-hydroxyfuran-2-one Traditional Name: 4-(cyclohexylmethyl)-5-(3,4-diethylphenyl)-5-hydroxy-3-piazthiol-5-yl-furan-2-one Formula: C27H30N2O3S MolecularWeight: 462.6037

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=NSN=C4C=C3)CC5CCCCC5)O)CC

Isomeric SMILES

CCC1=C(C=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=NSN=C4C=C3)CC5CCCCC5)O)CC

InChI

InChI=1S/C27H30N2O3S/c1-3-18-10-12-21(15-19(18)4-2)27(31)22(14-17-8-6-5-7-9-17)25(26(30)32-27)20-11-13-23-24(16-20)29-33-28-23/h10-13,15-17,31H,3-9,14H2,1-2H3