N-(1,3-benzothiazol-2-ylmethyl)-4-(2-chlorophenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(2-chlorophenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(2-chlorophenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(2-chlorophenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(2-chlorophenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(2-chlorophenyl)sulfonyl-piperazine-1-carboxamide Formula: C19H19ClN4O3S2 MolecularWeight: 450.96216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1C(=O)NCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C19H19ClN4O3S2/c20-14-5-1-4-8-17(14)29(26,27)24-11-9-23(10-12-24)19(25)21-13-18-22-15-6-2-3-7-16(15)28-18/h1-8H,9-13H2,(H,21,25)