N-(3-chloranyl-4-methyl-phenyl)-4-methylsulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-4-methylsulfonyl-piperazine-1-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-4-methylsulfonyl-piperazine-1-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-4-methylsulfonyl-1-piperazinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-4-methylsulfonylpiperazine-1-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-4-mesyl-piperazine-1-carboxamide Formula: C13H18ClN3O3S MolecularWeight: 331.81832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C)Cl

InChI

InChI=1S/C13H18ClN3O3S/c1-10-3-4-11(9-12(10)14)15-13(18)16-5-7-17(8-6-16)21(2,19)20/h3-4,9H,5-8H2,1-2H3,(H,15,18)