4-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-oxidanyl-naphthalene-2-carboxamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-oxidanyl-naphthalene-2-carboxamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-naphthalene-2-carboxamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-[1-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-hydroxy-2-naphthalenecarboxamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-hydroxynaphthalene-2-carboxamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-[1-(2,4-ditert-amylphenoxy)butyl]-1-hydroxy-2-naphthamide Formula: C38H44N2O3S2 MolecularWeight: 640.89756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(NC(=O)C1=C(C2=CC=CC=C2C(=C1)SC3=NC4=CC=CC=C4S3)O)OC5=C(C=C(C=C5)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCCC(NC(=O)C1=C(C2=CC=CC=C2C(=C1)SC3=NC4=CC=CC=C4S3)O)OC5=C(C=C(C=C5)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C38H44N2O3S2/c1-8-15-33(43-30-21-20-24(37(4,5)9-2)22-28(30)38(6,7)10-3)40-35(42)27-23-32(25-16-11-12-17-26(25)34(27)41)45-36-39-29-18-13-14-19-31(29)44-36/h11-14,16-23,33,41H,8-10,15H2,1-7H3,(H,40,42)