N,3-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-2-(phenylcarbamoylamino)butanamide

Systemtic Name: N,3-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-2-(phenylcarbamoylamino)butanamide Openeye Name: N,3-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-2-(phenylcarbamoylamino)butanamide CAS Name: 2-[[anilino(oxo)methyl]amino]-N,3-dimethyl-N-[[4-(methylthio)phenyl]methyl]butanamide IUPAC Name: N,3-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-2-(phenylcarbamoylamino)butanamide Traditional Name: N,3-dimethyl-N-[4-(methylthio)benzyl]-2-(phenylcarbamoylamino)butyramide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C)CC1=CC=C(C=C1)SC)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)N(C)CC1=CC=C(C=C1)SC)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H27N3O2S/c1-15(2)19(23-21(26)22-17-8-6-5-7-9-17)20(25)24(3)14-16-10-12-18(27-4)13-11-16/h5-13,15,19H,14H2,1-4H3,(H2,22,23,26)