5-chloranyl-N-[2-(phenylcarbamoyl)-1-benzofuran-3-yl]-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(phenylcarbamoyl)-1-benzofuran-3-yl]-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-isopropylsulfanyl-N-[2-(phenylcarbamoyl)benzofuran-3-yl]pyrimidine-4-carboxamide CAS Name: N-[2-[anilino(oxo)methyl]-3-benzofuranyl]-5-chloro-2-(propan-2-ylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[2-(phenylcarbamoyl)-1-benzofuran-3-yl]-2-propan-2-ylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(isopropylthio)-N-[2-(phenylcarbamoyl)benzofuran-3-yl]pyrimidine-4-carboxamide Formula: C23H19ClN4O3S MolecularWeight: 466.93996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC=C(C(=N1)C(=O)NC2=C(OC3=CC=CC=C32)C(=O)NC4=CC=CC=C4)Cl

Isomeric SMILES

CC(C)SC1=NC=C(C(=N1)C(=O)NC2=C(OC3=CC=CC=C32)C(=O)NC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H19ClN4O3S/c1-13(2)32-23-25-12-16(24)19(28-23)21(29)27-18-15-10-6-7-11-17(15)31-20(18)22(30)26-14-8-4-3-5-9-14/h3-13H,1-2H3,(H,26,30)(H,27,29)