propan-2-yl 2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylethanoate

Systemtic Name: propan-2-yl 2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylethanoate Openeye Name: isopropyl 2-[[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylacetate Traditional Name: 2-[[5-(4-methylpiperazino)sulfonyl-2-pyridyl]thio]acetic acid isopropyl ester Formula: C15H23N3O4S2 MolecularWeight: 373.49082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CSC1=NC=C(C=C1)S(=O)(=O)N2CCN(CC2)C

Isomeric SMILES

CC(C)OC(=O)CSC1=NC=C(C=C1)S(=O)(=O)N2CCN(CC2)C

InChI

InChI=1S/C15H23N3O4S2/c1-12(2)22-15(19)11-23-14-5-4-13(10-16-14)24(20,21)18-8-6-17(3)7-9-18/h4-5,10,12H,6-9,11H2,1-3H3