N-(2,5-dimethylphenyl)-4-(phenylmethylsulfanyl)butanamide

Systemtic Name: N-(2,5-dimethylphenyl)-4-(phenylmethylsulfanyl)butanamide Openeye Name: 4-benzylsulfanyl-N-(2,5-dimethylphenyl)butanamide CAS Name: N-(2,5-dimethylphenyl)-4-(phenylmethylthio)butanamide IUPAC Name: 4-benzylsulfanyl-N-(2,5-dimethylphenyl)butanamide Traditional Name: 4-(benzylthio)-N-(2,5-dimethylphenyl)butyramide Formula: C19H23NOS MolecularWeight: 313.45702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CCCSCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CCCSCC2=CC=CC=C2

InChI

InChI=1S/C19H23NOS/c1-15-10-11-16(2)18(13-15)20-19(21)9-6-12-22-14-17-7-4-3-5-8-17/h3-5,7-8,10-11,13H,6,9,12,14H2,1-2H3,(H,20,21)