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

Systemtic Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-4-(morpholin-4-ylmethyl)benzamide Openeye Name: N-[(1S)-1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-(morpholinomethyl)benzamide CAS Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-(4-morpholinylmethyl)benzamide IUPAC Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-4-(morpholin-4-ylmethyl)benzamide Traditional Name: N-[(1S)-1-(cyanomethylcarbamoyl)-3-methyl-butyl]-4-(morpholinomethyl)benzamide Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC(=O)C1=CC=C(C=C1)CN2CCOCC2

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCC#N)NC(=O)C1=CC=C(C=C1)CN2CCOCC2

InChI

InChI=1S/C20H28N4O3/c1-15(2)13-18(20(26)22-8-7-21)23-19(25)17-5-3-16(4-6-17)14-24-9-11-27-12-10-24/h3-6,15,18H,8-14H2,1-2H3,(H,22,26)(H,23,25)/t18-/m0/s1