2-[[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl]amino]-N-prop-2-ynyl-benzamide

Systemtic Name: 2-[[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl]amino]-N-prop-2-ynyl-benzamide Openeye Name: 2-[[2-[4-(cyanomethyl)anilino]-2-oxo-ethyl]amino]-N-prop-2-ynyl-benzamide CAS Name: 2-[[2-[4-(cyanomethyl)anilino]-2-oxoethyl]amino]-N-prop-2-ynylbenzamide IUPAC Name: 2-[[2-[4-(cyanomethyl)anilino]-2-oxoethyl]amino]-N-prop-2-ynylbenzamide Traditional Name: 2-[[2-[4-(cyanomethyl)anilino]-2-keto-ethyl]amino]-N-propargyl-benzamide Formula: C20H18N4O2 MolecularWeight: 346.38252

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C1=CC=CC=C1NCC(=O)NC2=CC=C(C=C2)CC#N

Isomeric SMILES

C#CCNC(=O)C1=CC=CC=C1NCC(=O)NC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C20H18N4O2/c1-2-13-22-20(26)17-5-3-4-6-18(17)23-14-19(25)24-16-9-7-15(8-10-16)11-12-21/h1,3-10,23H,11,13-14H2,(H,22,26)(H,24,25)