(2S)-N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide

Systemtic Name: (2S)-N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide Openeye Name: (2S)-N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-3-methyl-2-(p-tolylsulfonylamino)butanamide CAS Name: (2S)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide IUPAC Name: (2S)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide Traditional Name: (2S)-N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-3-methyl-2-(tosylamino)butyramide Formula: C20H29N3O3S2 MolecularWeight: 423.59256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NCC(C2=CC=CS2)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)NCC(C2=CC=CS2)N(C)C

InChI

InChI=1S/C20H29N3O3S2/c1-14(2)19(22-28(25,26)16-10-8-15(3)9-11-16)20(24)21-13-17(23(4)5)18-7-6-12-27-18/h6-12,14,17,19,22H,13H2,1-5H3,(H,21,24)/t17?,19-/m0/s1