2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[(1R)-1-phenylethyl]butanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[(1R)-1-phenylethyl]butanamide Openeye Name: 2-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-[(1R)-1-phenylethyl]butanamide CAS Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[(1R)-1-phenylethyl]butanamide IUPAC Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-[(1R)-1-phenylethyl]butanamide Traditional Name: 2-(N-mesyl-3,4-dimethyl-anilino)-N-[(1R)-1-phenylethyl]butyramide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(C(=O)N[C@H](C)C1=CC=CC=C1)N(C2=CC(=C(C=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C21H28N2O3S/c1-6-20(21(24)22-17(4)18-10-8-7-9-11-18)23(27(5,25)26)19-13-12-15(2)16(3)14-19/h7-14,17,20H,6H2,1-5H3,(H,22,24)/t17-,20?/m1/s1