N-(2-cyanoethyl)-N-methyl-3-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanamide

Systemtic Name: N-(2-cyanoethyl)-N-methyl-3-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanamide Openeye Name: N-(2-cyanoethyl)-N-methyl-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide CAS Name: N-(2-cyanoethyl)-N-methyl-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide Traditional Name: N-(2-cyanoethyl)-N-methyl-3-(1,1,3-triketo-1,2-benzothiazol-2-yl)propionamide Formula: C14H15N3O4S MolecularWeight: 321.3516

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CCN1C(=O)C2=CC=CC=C2S1(=O)=O

Isomeric SMILES

CN(CCC#N)C(=O)CCN1C(=O)C2=CC=CC=C2S1(=O)=O

InChI

InChI=1S/C14H15N3O4S/c1-16(9-4-8-15)13(18)7-10-17-14(19)11-5-2-3-6-12(11)22(17,20)21/h2-3,5-6H,4,7,9-10H2,1H3