N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]-1-benzofuran-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]-1-benzofuran-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]benzofuran-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-3-benzofuranyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-[(5-chloropyridin-2-yl)carbamoyl]-1-benzofuran-3-yl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]benzofuran-3-yl]-1-mesyl-isonipecotamide Formula: C21H21ClN4O5S MolecularWeight: 476.93324

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=C(OC3=CC=CC=C32)C(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=C(OC3=CC=CC=C32)C(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN4O5S/c1-32(29,30)26-10-8-13(9-11-26)20(27)25-18-15-4-2-3-5-16(15)31-19(18)21(28)24-17-7-6-14(22)12-23-17/h2-7,12-13H,8-11H2,1H3,(H,25,27)(H,23,24,28)