N-(1,3-benzothiazol-2-yl)-4-[bis(2-cyanoethyl)sulfamoyl]-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-[bis(2-cyanoethyl)sulfamoyl]-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-[bis(2-cyanoethyl)sulfamoyl]-N-(2-pyridylmethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-[bis(2-cyanoethyl)sulfamoyl]-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-[bis(2-cyanoethyl)sulfamoyl]-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-[bis(2-cyanoethyl)sulfamoyl]-N-(2-pyridylmethyl)benzamide Formula: C26H22N6O3S2 MolecularWeight: 530.62128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N(CCC#N)CCC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C26H22N6O3S2/c27-14-5-17-31(18-6-15-28)37(34,35)22-12-10-20(11-13-22)25(33)32(19-21-7-3-4-16-29-21)26-30-23-8-1-2-9-24(23)36-26/h1-4,7-13,16H,5-6,17-19H2