N-(1,3-benzothiazol-2-yl)-2-[1-(2-methylphenyl)-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[1-(2-methylphenyl)-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[6-hydroxy-1-(o-tolyl)-4-oxo-pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[[6-hydroxy-1-(2-methylphenyl)-4-oxo-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[6-hydroxy-1-(2-methylphenyl)-4-oxopyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[[6-hydroxy-4-keto-1-(o-tolyl)pyrimidin-2-yl]thio]acetamide Formula: C20H16N4O3S2 MolecularWeight: 424.49604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=O)N=C2SCC(=O)NC3=NC4=CC=CC=C4S3)O

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=O)N=C2SCC(=O)NC3=NC4=CC=CC=C4S3)O

InChI

InChI=1S/C20H16N4O3S2/c1-12-6-2-4-8-14(12)24-18(27)10-16(25)23-20(24)28-11-17(26)22-19-21-13-7-3-5-9-15(13)29-19/h2-10,27H,11H2,1H3,(H,21,22,26)