4-[bis(2-cyanoethyl)sulfamoyl]-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(2-dimethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Formula: C25H28N6O3S2 MolecularWeight: 524.65822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C25H28N6O3S2/c1-19-6-11-22-23(18-19)35-25(28-22)31(17-16-29(2)3)24(32)20-7-9-21(10-8-20)36(33,34)30(14-4-12-26)15-5-13-27/h6-11,18H,4-5,14-17H2,1-3H3