N-(2,6-dimethylphenyl)-4-(4-oxidanyl-3,5-diphenyl-phenyl)sulfanyl-butanamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-(4-oxidanyl-3,5-diphenyl-phenyl)sulfanyl-butanamide Openeye Name: N-(2,6-dimethylphenyl)-4-(4-hydroxy-3,5-diphenyl-phenyl)sulfanyl-butanamide CAS Name: N-(2,6-dimethylphenyl)-4-[(4-hydroxy-3,5-diphenylphenyl)thio]butanamide IUPAC Name: N-(2,6-dimethylphenyl)-4-(4-hydroxy-3,5-diphenylphenyl)sulfanylbutanamide Traditional Name: N-(2,6-dimethylphenyl)-4-[(4-hydroxy-3,5-diphenyl-phenyl)thio]butyramide Formula: C30H29NO2S MolecularWeight: 467.62176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSC2=CC(=C(C(=C2)C3=CC=CC=C3)O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSC2=CC(=C(C(=C2)C3=CC=CC=C3)O)C4=CC=CC=C4

InChI

InChI=1S/C30H29NO2S/c1-21-11-9-12-22(2)29(21)31-28(32)17-10-18-34-25-19-26(23-13-5-3-6-14-23)30(33)27(20-25)24-15-7-4-8-16-24/h3-9,11-16,19-20,33H,10,17-18H2,1-2H3,(H,31,32)