3-tert-butyl-5-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 3-tert-butyl-5-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-tert-butyl-5-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 3-tert-butyl-5-[[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-tert-butyl-5-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-tert-butyl-5-[[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]methyl]-1,2,4-oxadiazole Formula: C19H18N4OS2 MolecularWeight: 382.50242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=N1)CSC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NOC(=N1)CSC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C19H18N4OS2/c1-19(2,3)18-22-15(24-23-18)10-25-16-13-9-14(12-7-5-4-6-8-12)26-17(13)21-11-20-16/h4-9,11H,10H2,1-3H3