7-[(4-methylphenyl)methylsulfanyl]-3-thiophen-2-yl-[1,2]thiazolo[4,5-d]pyrimidine

Systemtic Name: 7-[(4-methylphenyl)methylsulfanyl]-3-thiophen-2-yl-[1,2]thiazolo[4,5-d]pyrimidine Openeye Name: 7-(p-tolylmethylsulfanyl)-3-(2-thienyl)isothiazolo[4,5-d]pyrimidine CAS Name: 7-[(4-methylphenyl)methylthio]-3-thiophen-2-ylisothiazolo[4,5-d]pyrimidine IUPAC Name: 7-[(4-methylphenyl)methylsulfanyl]-3-thiophen-2-yl-[1,2]thiazolo[4,5-d]pyrimidine Traditional Name: 7-[(4-methylbenzyl)thio]-3-(2-thienyl)isothiazolo[4,5-d]pyrimidine Formula: C17H13N3S3 MolecularWeight: 355.50022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC=NC3=C2SN=C3C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC=NC3=C2SN=C3C4=CC=CS4

InChI

InChI=1S/C17H13N3S3/c1-11-4-6-12(7-5-11)9-22-17-16-15(18-10-19-17)14(20-23-16)13-3-2-8-21-13/h2-8,10H,9H2,1H3