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

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-[2-[(3-methoxyphenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-[4-keto-2-(m-anisylthio)-6-methyl-1H-pyrimidin-5-yl]acetamide Formula: C22H19ClN4O3S2 MolecularWeight: 486.99426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN4O3S2/c1-12-16(10-19(28)26-22-25-17-7-6-14(23)9-18(17)32-22)20(29)27-21(24-12)31-11-13-4-3-5-15(8-13)30-2/h3-9H,10-11H2,1-2H3,(H,24,27,29)(H,25,26,28)