N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-4-[(4-chlorophenyl)sulfanylmethyl]-N-methyl-benzamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-4-[(4-chlorophenyl)sulfanylmethyl]-N-methyl-benzamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-4-[(4-chlorophenyl)sulfanylmethyl]-N-methyl-benzamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-4-[[(4-chlorophenyl)thio]methyl]-N-methylbenzamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-4-[(4-chlorophenyl)sulfanylmethyl]-N-methylbenzamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-4-[[(4-chlorophenyl)thio]methyl]-N-methyl-benzamide Formula: C21H25ClN2O2S MolecularWeight: 404.9534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)C1=CC=C(C=C1)CSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)C1=CC=C(C=C1)CSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H25ClN2O2S/c1-21(2,3)23-19(25)13-24(4)20(26)16-7-5-15(6-8-16)14-27-18-11-9-17(22)10-12-18/h5-12H,13-14H2,1-4H3,(H,23,25)