N-[(2S)-1-(2-acetamidoethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzamide

Systemtic Name: N-[(2S)-1-(2-acetamidoethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzamide Openeye Name: N-[(1S)-1-(2-acetamidoethylcarbamoyl)-2-methyl-propyl]-4-methyl-benzamide CAS Name: N-[(2S)-1-(2-acetamidoethylamino)-3-methyl-1-oxobutan-2-yl]-4-methylbenzamide IUPAC Name: N-[(2S)-1-(2-acetamidoethylamino)-3-methyl-1-oxobutan-2-yl]-4-methylbenzamide Traditional Name: N-[(1S)-1-(2-acetamidoethylcarbamoyl)-2-methyl-propyl]-4-methyl-benzamide Formula: C17H25N3O3 MolecularWeight: 319.3987

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NCCNC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)NCCNC(=O)C

InChI

InChI=1S/C17H25N3O3/c1-11(2)15(17(23)19-10-9-18-13(4)21)20-16(22)14-7-5-12(3)6-8-14/h5-8,11,15H,9-10H2,1-4H3,(H,18,21)(H,19,23)(H,20,22)/t15-/m0/s1