N-[3,5-dimethyl-4-(4-phenylmethoxy-3-propan-2-yl-phenyl)sulfanyl-phenyl]butanamide

Systemtic Name: N-[3,5-dimethyl-4-(4-phenylmethoxy-3-propan-2-yl-phenyl)sulfanyl-phenyl]butanamide Openeye Name: N-[4-(4-benzyloxy-3-isopropyl-phenyl)sulfanyl-3,5-dimethyl-phenyl]butanamide CAS Name: N-[3,5-dimethyl-4-[(4-phenylmethoxy-3-propan-2-ylphenyl)thio]phenyl]butanamide IUPAC Name: N-[3,5-dimethyl-4-(4-phenylmethoxy-3-propan-2-ylphenyl)sulfanylphenyl]butanamide Traditional Name: N-[4-[(4-benzoxy-3-isopropyl-phenyl)thio]-3,5-dimethyl-phenyl]butyramide Formula: C28H33NO2S MolecularWeight: 447.63212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C(=C1)C)SC2=CC(=C(C=C2)OCC3=CC=CC=C3)C(C)C)C

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C(=C1)C)SC2=CC(=C(C=C2)OCC3=CC=CC=C3)C(C)C)C

InChI

InChI=1S/C28H33NO2S/c1-6-10-27(30)29-23-15-20(4)28(21(5)16-23)32-24-13-14-26(25(17-24)19(2)3)31-18-22-11-8-7-9-12-22/h7-9,11-17,19H,6,10,18H2,1-5H3,(H,29,30)