N-[1-(cyanomethylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-4-morpholin-4-yl-benzamide

Systemtic Name: N-[1-(cyanomethylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-4-morpholin-4-yl-benzamide Openeye Name: N-[2-(cyanomethylamino)-1-(2-naphthylmethyl)-2-oxo-ethyl]-4-morpholino-benzamide CAS Name: N-[1-(cyanomethylamino)-3-(2-naphthalenyl)-1-oxopropan-2-yl]-4-(4-morpholinyl)benzamide IUPAC Name: N-[1-(cyanomethylamino)-3-naphthalen-2-yl-1-oxopropan-2-yl]-4-morpholin-4-ylbenzamide Traditional Name: N-[2-(cyanomethylamino)-2-keto-1-(2-naphthylmethyl)ethyl]-4-morpholino-benzamide Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)C(=O)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)NCC#N

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)C(=O)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)NCC#N

InChI

InChI=1S/C26H26N4O3/c27-11-12-28-26(32)24(18-19-5-6-20-3-1-2-4-22(20)17-19)29-25(31)21-7-9-23(10-8-21)30-13-15-33-16-14-30/h1-10,17,24H,12-16,18H2,(H,28,32)(H,29,31)