N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-5-methyl-1H-pyrazole-3-carboxamide

Systemtic Name: N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-5-methyl-1H-pyrazole-3-carboxamide Openeye Name: N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-5-methyl-1H-pyrazole-3-carboxamide CAS Name: N-[2-[(3-methoxy-3-methylbutyl)thio]-1,3-benzothiazol-6-yl]-5-methyl-1H-pyrazole-3-carboxamide IUPAC Name: N-[2-(3-methoxy-3-methylbutyl)sulfanyl-1,3-benzothiazol-6-yl]-5-methyl-1H-pyrazole-3-carboxamide Traditional Name: N-[2-[(3-methoxy-3-methyl-butyl)thio]-1,3-benzothiazol-6-yl]-5-methyl-1H-pyrazole-3-carboxamide Formula: C18H22N4O2S2 MolecularWeight: 390.52288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC(C)(C)OC

Isomeric SMILES

CC1=CC(=NN1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC(C)(C)OC

InChI

InChI=1S/C18H22N4O2S2/c1-11-9-14(22-21-11)16(23)19-12-5-6-13-15(10-12)26-17(20-13)25-8-7-18(2,3)24-4/h5-6,9-10H,7-8H2,1-4H3,(H,19,23)(H,21,22)