2-[[4-[5-(3,4-dichlorophenyl)pyrimidin-2-yl]piperazin-1-yl]sulfonylmethyl]-N-methyl-butanamide

Systemtic Name: 2-[[4-[5-(3,4-dichlorophenyl)pyrimidin-2-yl]piperazin-1-yl]sulfonylmethyl]-N-methyl-butanamide Openeye Name: 2-[[4-[5-(3,4-dichlorophenyl)pyrimidin-2-yl]piperazin-1-yl]sulfonylmethyl]-N-methyl-butanamide CAS Name: 2-[[4-[5-(3,4-dichlorophenyl)-2-pyrimidinyl]-1-piperazinyl]sulfonylmethyl]-N-methylbutanamide IUPAC Name: 2-[[4-[5-(3,4-dichlorophenyl)pyrimidin-2-yl]piperazin-1-yl]sulfonylmethyl]-N-methylbutanamide Traditional Name: 2-[[4-[5-(3,4-dichlorophenyl)pyrimidin-2-yl]piperazino]sulfonylmethyl]-N-methyl-butyramide Formula: C20H25Cl2N5O3S MolecularWeight: 486.4152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CS(=O)(=O)N1CCN(CC1)C2=NC=C(C=N2)C3=CC(=C(C=C3)Cl)Cl)C(=O)NC

Isomeric SMILES

CCC(CS(=O)(=O)N1CCN(CC1)C2=NC=C(C=N2)C3=CC(=C(C=C3)Cl)Cl)C(=O)NC

InChI

InChI=1S/C20H25Cl2N5O3S/c1-3-14(19(28)23-2)13-31(29,30)27-8-6-26(7-9-27)20-24-11-16(12-25-20)15-4-5-17(21)18(22)10-15/h4-5,10-12,14H,3,6-9,13H2,1-2H3,(H,23,28)