6-morpholin-4-yl-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]pyrazine-2-carboxamide

Systemtic Name: 6-morpholin-4-yl-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]pyrazine-2-carboxamide Openeye Name: 6-morpholino-N-[2-[2-(3-thienyl)ethylsulfanyl]-1,3-benzothiazol-6-yl]pyrazine-2-carboxamide CAS Name: 6-(4-morpholinyl)-N-[2-[2-(3-thiophenyl)ethylthio]-1,3-benzothiazol-6-yl]-2-pyrazinecarboxamide IUPAC Name: 6-morpholin-4-yl-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]pyrazine-2-carboxamide Traditional Name: 6-morpholino-N-[2-[2-(3-thienyl)ethylthio]-1,3-benzothiazol-6-yl]pyrazinamide Formula: C22H21N5O2S3 MolecularWeight: 483.62944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=CN=C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCCC5=CSC=C5

Isomeric SMILES

C1COCCN1C2=NC(=CN=C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCCC5=CSC=C5

InChI

InChI=1S/C22H21N5O2S3/c28-21(18-12-23-13-20(25-18)27-5-7-29-8-6-27)24-16-1-2-17-19(11-16)32-22(26-17)31-10-4-15-3-9-30-14-15/h1-3,9,11-14H,4-8,10H2,(H,24,28)