ethyl 2-piperazin-1-yl-4-propylsulfonyl-2-pyrimidin-2-yl-butanoate

Systemtic Name: ethyl 2-piperazin-1-yl-4-propylsulfonyl-2-pyrimidin-2-yl-butanoate Openeye Name: ethyl 2-piperazin-1-yl-4-propylsulfonyl-2-pyrimidin-2-yl-butanoate CAS Name: 2-(1-piperazinyl)-4-propylsulfonyl-2-(2-pyrimidinyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-piperazin-1-yl-4-propylsulfonyl-2-pyrimidin-2-ylbutanoate Traditional Name: 2-piperazino-4-propylsulfonyl-2-(2-pyrimidyl)butyric acid ethyl ester Formula: C17H28N4O4S MolecularWeight: 384.49362

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)CCC(C1=NC=CC=N1)(C(=O)OCC)N2CCNCC2

Isomeric SMILES

CCCS(=O)(=O)CCC(C1=NC=CC=N1)(C(=O)OCC)N2CCNCC2

InChI

InChI=1S/C17H28N4O4S/c1-3-13-26(23,24)14-6-17(16(22)25-4-2,15-19-7-5-8-20-15)21-11-9-18-10-12-21/h5,7-8,18H,3-4,6,9-14H2,1-2H3