N-[4-(3-tert-butyl-4-methoxy-phenyl)sulfanyl-3,5-bis(chloranyl)phenyl]butanamide

Systemtic Name: N-[4-(3-tert-butyl-4-methoxy-phenyl)sulfanyl-3,5-bis(chloranyl)phenyl]butanamide Openeye Name: N-[4-(3-tert-butyl-4-methoxy-phenyl)sulfanyl-3,5-dichloro-phenyl]butanamide CAS Name: N-[4-[(3-tert-butyl-4-methoxyphenyl)thio]-3,5-dichlorophenyl]butanamide IUPAC Name: N-[4-(3-tert-butyl-4-methoxyphenyl)sulfanyl-3,5-dichlorophenyl]butanamide Traditional Name: N-[4-[(3-tert-butyl-4-methoxy-phenyl)thio]-3,5-dichloro-phenyl]butyramide Formula: C21H25Cl2NO2S MolecularWeight: 426.3997

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C(=C1)Cl)SC2=CC(=C(C=C2)OC)C(C)(C)C)Cl

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C(=C1)Cl)SC2=CC(=C(C=C2)OC)C(C)(C)C)Cl

InChI

InChI=1S/C21H25Cl2NO2S/c1-6-7-19(25)24-13-10-16(22)20(17(23)11-13)27-14-8-9-18(26-5)15(12-14)21(2,3)4/h8-12H,6-7H2,1-5H3,(H,24,25)