N-benzo[e][1,3]benzothiazol-2-yl-2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-2-[(4-cyanophenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-2-[(4-cyanophenyl)sulfonyl-methylamino]acetamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetamide Formula: C21H16N4O3S2 MolecularWeight: 436.50674

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=NC2=C(S1)C=CC3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CN(CC(=O)NC1=NC2=C(S1)C=CC3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H16N4O3S2/c1-25(30(27,28)16-9-6-14(12-22)7-10-16)13-19(26)23-21-24-20-17-5-3-2-4-15(17)8-11-18(20)29-21/h2-11H,13H2,1H3,(H,23,24,26)