N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-methylsulfonyl-phenyl]piperazine-1-carboxamide

Systemtic Name: N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-methylsulfonyl-phenyl]piperazine-1-carboxamide Openeye Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]-4-methylsulfonyl-phenyl]piperazine-1-carboxamide CAS Name: N-[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-4-methylsulfonylphenyl]-1-piperazinecarboxamide IUPAC Name: N-[2-[(5-chloropyridin-2-yl)carbamoyl]-4-methylsulfonylphenyl]piperazine-1-carboxamide Traditional Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]-4-mesyl-phenyl]piperazine-1-carboxamide Formula: C18H20ClN5O4S MolecularWeight: 437.9005

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NC(=O)N2CCNCC2)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NC(=O)N2CCNCC2)C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C18H20ClN5O4S/c1-29(27,28)13-3-4-15(22-18(26)24-8-6-20-7-9-24)14(10-13)17(25)23-16-5-2-12(19)11-21-16/h2-5,10-11,20H,6-9H2,1H3,(H,22,26)(H,21,23,25)