5-chloranyl-N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide Openeye Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-5-chloro-2-isopropylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-2-(propan-2-ylthio)-4-pyrimidinecarboxamide IUPAC Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-5-chloro-2-propan-2-ylsulfanylpyrimidine-4-carboxamide Traditional Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-5-chloro-2-(isopropylthio)pyrimidine-4-carboxamide Formula: C22H23ClN4O3S2 MolecularWeight: 491.02602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N(C)CC3=CC=CC=C3)Cl

Isomeric SMILES

CC(C)SC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N(C)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H23ClN4O3S2/c1-15(2)31-22-24-13-19(23)20(26-22)21(28)25-17-9-11-18(12-10-17)32(29,30)27(3)14-16-7-5-4-6-8-16/h4-13,15H,14H2,1-3H3,(H,25,28)