N-(cyanomethyl)-N'-(6-ethoxy-1,3-benzothiazol-2-yl)ethanediamide

Systemtic Name: N-(cyanomethyl)-N'-(6-ethoxy-1,3-benzothiazol-2-yl)ethanediamide Openeye Name: N-(cyanomethyl)-N'-(6-ethoxy-1,3-benzothiazol-2-yl)oxamide CAS Name: N-(cyanomethyl)-N'-(6-ethoxy-1,3-benzothiazol-2-yl)oxamide IUPAC Name: N-(cyanomethyl)-N'-(6-ethoxy-1,3-benzothiazol-2-yl)oxamide Traditional Name: N-(cyanomethyl)-N'-(6-ethoxy-1,3-benzothiazol-2-yl)oxamide Formula: C13H12N4O3S MolecularWeight: 304.32438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)NCC#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)NCC#N

InChI

InChI=1S/C13H12N4O3S/c1-2-20-8-3-4-9-10(7-8)21-13(16-9)17-12(19)11(18)15-6-5-14/h3-4,7H,2,6H2,1H3,(H,15,18)(H,16,17,19)