N-(2-cyanoethyl)-2-[methyl-[1-(4-methylsulfonylphenyl)ethyl]amino]-N-phenyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[methyl-[1-(4-methylsulfonylphenyl)ethyl]amino]-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[methyl-[1-(4-methylsulfonylphenyl)ethyl]amino]-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[methyl-[1-(4-methylsulfonylphenyl)ethyl]amino]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[methyl-[1-(4-methylsulfonylphenyl)ethyl]amino]-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[1-(4-mesylphenyl)ethyl-methyl-amino]-N-phenyl-acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)CC(=O)N(CCC#N)C2=CC=CC=C2

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)CC(=O)N(CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C21H25N3O3S/c1-17(18-10-12-20(13-11-18)28(3,26)27)23(2)16-21(25)24(15-7-14-22)19-8-5-4-6-9-19/h4-6,8-13,17H,7,15-16H2,1-3H3