N-[2-(diethylamino)-2-phenyl-ethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide

Systemtic Name: N-[2-(diethylamino)-2-phenyl-ethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Openeye Name: N-[2-(diethylamino)-2-phenyl-ethyl]-4-[methyl(2-thienylsulfonyl)amino]butanamide CAS Name: N-[2-(diethylamino)-2-phenylethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide IUPAC Name: N-[2-(diethylamino)-2-phenylethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Traditional Name: N-[2-(diethylamino)-2-phenyl-ethyl]-4-[methyl(2-thienylsulfonyl)amino]butyramide Formula: C21H31N3O3S2 MolecularWeight: 437.61914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)CCCN(C)S(=O)(=O)C1=CC=CS1)C2=CC=CC=C2

Isomeric SMILES

CCN(CC)C(CNC(=O)CCCN(C)S(=O)(=O)C1=CC=CS1)C2=CC=CC=C2

InChI

InChI=1S/C21H31N3O3S2/c1-4-24(5-2)19(18-11-7-6-8-12-18)17-22-20(25)13-9-15-23(3)29(26,27)21-14-10-16-28-21/h6-8,10-12,14,16,19H,4-5,9,13,15,17H2,1-3H3,(H,22,25)