4-[(2-methylphenyl)methylsulfanyl]-N-(2,4,6-trimethylphenyl)butanamide

Systemtic Name: 4-[(2-methylphenyl)methylsulfanyl]-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: 4-(o-tolylmethylsulfanyl)-N-(2,4,6-trimethylphenyl)butanamide CAS Name: 4-[(2-methylphenyl)methylthio]-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: 4-[(2-methylphenyl)methylsulfanyl]-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: N-mesityl-4-[(2-methylbenzyl)thio]butyramide Formula: C21H27NOS MolecularWeight: 341.51018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCCCC(=O)NC2=C(C=C(C=C2C)C)C

Isomeric SMILES

CC1=CC=CC=C1CSCCCC(=O)NC2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C21H27NOS/c1-15-12-17(3)21(18(4)13-15)22-20(23)10-7-11-24-14-19-9-6-5-8-16(19)2/h5-6,8-9,12-13H,7,10-11,14H2,1-4H3,(H,22,23)