N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]ethanamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]ethanamide Openeye Name: 2-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-(6-chloro-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-[6-methyl-4-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]acetamide IUPAC Name: 2-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-(6-chloro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[2-(benzylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]-N-(6-chloro-1,3-benzothiazol-2-yl)acetamide Formula: C21H17ClN4O2S2 MolecularWeight: 456.96828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CC(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CC(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C21H17ClN4O2S2/c1-12-15(19(28)26-20(23-12)29-11-13-5-3-2-4-6-13)10-18(27)25-21-24-16-8-7-14(22)9-17(16)30-21/h2-9H,10-11H2,1H3,(H,23,26,28)(H,24,25,27)