5-chloranyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-isopropylsulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(propan-2-ylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propan-2-ylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(isopropylthio)-N-(6-methyl-1,3-benzothiazol-2-yl)pyrimidine-4-carboxamide Formula: C16H15ClN4OS2 MolecularWeight: 378.8995

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NC(=NC=C3Cl)SC(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NC(=NC=C3Cl)SC(C)C

InChI

InChI=1S/C16H15ClN4OS2/c1-8(2)23-15-18-7-10(17)13(20-15)14(22)21-16-19-11-5-4-9(3)6-12(11)24-16/h4-8H,1-3H3,(H,19,21,22)