3,3-dimethyl-N-(4-methylphenyl)-2-phenylsulfanyl-butanamide

Systemtic Name: 3,3-dimethyl-N-(4-methylphenyl)-2-phenylsulfanyl-butanamide Openeye Name: 3,3-dimethyl-2-phenylsulfanyl-N-(p-tolyl)butanamide CAS Name: 3,3-dimethyl-N-(4-methylphenyl)-2-(phenylthio)butanamide IUPAC Name: 3,3-dimethyl-N-(4-methylphenyl)-2-phenylsulfanylbutanamide Traditional Name: 3,3-dimethyl-2-(phenylthio)-N-(p-tolyl)butyramide Formula: C19H23NOS MolecularWeight: 313.45702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C(C)(C)C)SC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C(C)(C)C)SC2=CC=CC=C2

InChI

InChI=1S/C19H23NOS/c1-14-10-12-15(13-11-14)20-18(21)17(19(2,3)4)22-16-8-6-5-7-9-16/h5-13,17H,1-4H3,(H,20,21)