N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-2-(2-pyrazin-2-yl-1,3-thiazol-4-yl)ethanamide

Systemtic Name: N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-2-(2-pyrazin-2-yl-1,3-thiazol-4-yl)ethanamide Openeye Name: N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-2-(2-pyrazin-2-ylthiazol-4-yl)acetamide CAS Name: N-[2-[(3-methoxy-3-methylbutyl)thio]-1,3-benzothiazol-6-yl]-2-[2-(2-pyrazinyl)-4-thiazolyl]acetamide IUPAC Name: N-[2-(3-methoxy-3-methylbutyl)sulfanyl-1,3-benzothiazol-6-yl]-2-(2-pyrazin-2-yl-1,3-thiazol-4-yl)acetamide Traditional Name: N-[2-[(3-methoxy-3-methyl-butyl)thio]-1,3-benzothiazol-6-yl]-2-(2-pyrazin-2-ylthiazol-4-yl)acetamide Formula: C22H23N5O2S3 MolecularWeight: 485.64532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CC3=CSC(=N3)C4=NC=CN=C4)OC

Isomeric SMILES

CC(C)(CCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CC3=CSC(=N3)C4=NC=CN=C4)OC

InChI

InChI=1S/C22H23N5O2S3/c1-22(2,29-3)6-9-30-21-27-16-5-4-14(10-18(16)32-21)25-19(28)11-15-13-31-20(26-15)17-12-23-7-8-24-17/h4-5,7-8,10,12-13H,6,9,11H2,1-3H3,(H,25,28)