N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-4-[(2-hydroxyethylamino)methyl]benzamide

Systemtic Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-4-[(2-hydroxyethylamino)methyl]benzamide Openeye Name: N-[(1S)-1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-[(2-hydroxyethylamino)methyl]benzamide CAS Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-[(2-hydroxyethylamino)methyl]benzamide IUPAC Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-[(2-hydroxyethylamino)methyl]benzamide Traditional Name: N-[(1S)-1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-[(2-hydroxyethylamino)methyl]benzamide Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC(=O)C1=CC=C(C=C1)CNCCO

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCC#N)NC(=O)C1=CC=C(C=C1)CNCCO

InChI

InChI=1S/C18H26N4O3/c1-13(2)11-16(18(25)21-8-7-19)22-17(24)15-5-3-14(4-6-15)12-20-9-10-23/h3-6,13,16,20,23H,8-12H2,1-2H3,(H,21,25)(H,22,24)/t16-/m0/s1