N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetamide Formula: C22H20N4OS2 MolecularWeight: 420.5504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N(C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N(C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H20N4OS2/c1-15-12-18(16-8-4-3-5-9-16)25-22(23-15)28-14-21(27)26(2)13-20-24-17-10-6-7-11-19(17)29-20/h3-12H,13-14H2,1-2H3