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

Systemtic Name: 5-chloranyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propylsulfonyl-pyrimidine-4-carboxamide Formula: C16H15ClN4O3S2 MolecularWeight: 410.8983

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C)Cl

Isomeric SMILES

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C)Cl

InChI

InChI=1S/C16H15ClN4O3S2/c1-3-6-26(23,24)16-18-8-10(17)13(20-16)14(22)21-15-19-11-5-4-9(2)7-12(11)25-15/h4-5,7-8H,3,6H2,1-2H3,(H,19,21,22)