N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-3,4-dihydro-2H-quinoline-1-carboxamide

Systemtic Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-3,4-dihydro-2H-quinoline-1-carboxamide Openeye Name: N-[(1S)-1-(cyanomethylcarbamoyl)-3-methyl-butyl]-3,4-dihydro-2H-quinoline-1-carboxamide CAS Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-3,4-dihydro-2H-quinoline-1-carboxamide IUPAC Name: N-[(2S)-1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-3,4-dihydro-2H-quinoline-1-carboxamide Traditional Name: N-[(1S)-1-(cyanomethylcarbamoyl)-3-methyl-butyl]-3,4-dihydro-2H-quinoline-1-carboxamide Formula: C18H24N4O2 MolecularWeight: 328.40876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC(=O)N1CCCC2=CC=CC=C21

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCC#N)NC(=O)N1CCCC2=CC=CC=C21

InChI

InChI=1S/C18H24N4O2/c1-13(2)12-15(17(23)20-10-9-19)21-18(24)22-11-5-7-14-6-3-4-8-16(14)22/h3-4,6,8,13,15H,5,7,10-12H2,1-2H3,(H,20,23)(H,21,24)/t15-/m0/s1