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

Systemtic Name: N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-methylsulfonyl-phenyl]-4-propan-2-yl-piperazine-1-carboxamide Openeye Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]-4-methylsulfonyl-phenyl]-4-isopropyl-piperazine-1-carboxamide CAS Name: N-[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-4-methylsulfonylphenyl]-4-propan-2-yl-1-piperazinecarboxamide IUPAC Name: N-[2-[(5-chloropyridin-2-yl)carbamoyl]-4-methylsulfonylphenyl]-4-propan-2-ylpiperazine-1-carboxamide Traditional Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]-4-mesyl-phenyl]-4-isopropyl-piperazine-1-carboxamide Formula: C21H26ClN5O4S MolecularWeight: 479.98024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)NC2=C(C=C(C=C2)S(=O)(=O)C)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)NC2=C(C=C(C=C2)S(=O)(=O)C)C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C21H26ClN5O4S/c1-14(2)26-8-10-27(11-9-26)21(29)24-18-6-5-16(32(3,30)31)12-17(18)20(28)25-19-7-4-15(22)13-23-19/h4-7,12-14H,8-11H2,1-3H3,(H,24,29)(H,23,25,28)