4-tert-butyl-N-[2-[(4-tert-butylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[(4-tert-butylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-tert-butyl-N-[2-[(4-tert-butylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-tert-butyl-N-[2-[(4-tert-butylphenyl)methylthio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-tert-butyl-N-[2-[(4-tert-butylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-tert-butyl-N-[2-[(4-tert-butylbenzyl)thio]-1,3-benzothiazol-6-yl]benzamide Formula: C29H32N2OS2 MolecularWeight: 488.70718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C29H32N2OS2/c1-28(2,3)21-11-7-19(8-12-21)18-33-27-31-24-16-15-23(17-25(24)34-27)30-26(32)20-9-13-22(14-10-20)29(4,5)6/h7-17H,18H2,1-6H3,(H,30,32)