N-[4-(4-methoxy-3-propan-2-ylsulfanyl-phenoxy)-3,5-dimethyl-phenyl]butanamide

Systemtic Name: N-[4-(4-methoxy-3-propan-2-ylsulfanyl-phenoxy)-3,5-dimethyl-phenyl]butanamide Openeye Name: N-[4-(3-isopropylsulfanyl-4-methoxy-phenoxy)-3,5-dimethyl-phenyl]butanamide CAS Name: N-[4-[4-methoxy-3-(propan-2-ylthio)phenoxy]-3,5-dimethylphenyl]butanamide IUPAC Name: N-[4-(4-methoxy-3-propan-2-ylsulfanylphenoxy)-3,5-dimethylphenyl]butanamide Traditional Name: N-[4-[3-(isopropylthio)-4-methoxy-phenoxy]-3,5-dimethyl-phenyl]butyramide Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C(=C1)C)OC2=CC(=C(C=C2)OC)SC(C)C)C

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C(=C1)C)OC2=CC(=C(C=C2)OC)SC(C)C)C

InChI

InChI=1S/C22H29NO3S/c1-7-8-21(24)23-17-11-15(4)22(16(5)12-17)26-18-9-10-19(25-6)20(13-18)27-14(2)3/h9-14H,7-8H2,1-6H3,(H,23,24)