N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-3-methyl-2-(2-phenylethanoylamino)butanamide

Systemtic Name: N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-3-methyl-2-(2-phenylethanoylamino)butanamide Openeye Name: N-[1-(2,5-dimethyl-3-thienyl)ethyl]-3-methyl-2-[(2-phenylacetyl)amino]butanamide CAS Name: N-[1-(2,5-dimethyl-3-thiophenyl)ethyl]-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanamide IUPAC Name: N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-3-methyl-2-[(2-phenylacetyl)amino]butanamide Traditional Name: N-[1-(2,5-dimethyl-3-thienyl)ethyl]-3-methyl-2-[(2-phenylacetyl)amino]butyramide Formula: C21H28N2O2S MolecularWeight: 372.52422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(C)NC(=O)C(C(C)C)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(S1)C)C(C)NC(=O)C(C(C)C)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H28N2O2S/c1-13(2)20(23-19(24)12-17-9-7-6-8-10-17)21(25)22-15(4)18-11-14(3)26-16(18)5/h6-11,13,15,20H,12H2,1-5H3,(H,22,25)(H,23,24)