N-[2-chloranyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-phenyl]ethanamide

Systemtic Name: N-[2-chloranyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-phenyl]ethanamide Openeye Name: N-[2-chloro-4-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-phenyl]acetamide CAS Name: N-[2-chloro-4-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[2-chloro-4-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylphenyl]acetamide Traditional Name: N-[2-chloro-4-[4-(2-pyrimidyl)piperazino]sulfonyl-phenyl]acetamide Formula: C16H18ClN5O3S MolecularWeight: 395.86382

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3)Cl

InChI

InChI=1S/C16H18ClN5O3S/c1-12(23)20-15-4-3-13(11-14(15)17)26(24,25)22-9-7-21(8-10-22)16-18-5-2-6-19-16/h2-6,11H,7-10H2,1H3,(H,20,23)