N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-methyl-6-methylsulfanyl-2-thiophen-2-yl-pyrimidine-5-carboxamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-methyl-6-methylsulfanyl-2-thiophen-2-yl-pyrimidine-5-carboxamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-methyl-6-methylsulfanyl-2-(2-thienyl)pyrimidine-5-carboxamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-methyl-6-(methylthio)-2-thiophen-2-yl-5-pyrimidinecarboxamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-methyl-6-methylsulfanyl-2-thiophen-2-ylpyrimidine-5-carboxamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-methyl-6-(methylthio)-2-(2-thienyl)pyrimidine-5-carboxamide Formula: C20H18N4OS3 MolecularWeight: 426.57812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(N=C(N=C3SC)C4=CC=CS4)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(N=C(N=C3SC)C4=CC=CS4)C)C

InChI

InChI=1S/C20H18N4OS3/c1-10-8-11(2)16-14(9-10)28-20(22-16)24-18(25)15-12(3)21-17(23-19(15)26-4)13-6-5-7-27-13/h5-9H,1-4H3,(H,22,24,25)