N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)-2-(2-pyrimidylthio)acetamide Formula: C21H18N4OS2 MolecularWeight: 406.52382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CSC4=NC=CC=N4

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CSC4=NC=CC=N4

InChI

InChI=1S/C21H18N4OS2/c1-15-7-5-10-17-19(15)24-21(28-17)25(13-16-8-3-2-4-9-16)18(26)14-27-20-22-11-6-12-23-20/h2-12H,13-14H2,1H3