N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]-2-(4-propan-2-ylsulfanylphenyl)ethanamide

Systemtic Name: N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]-2-(4-propan-2-ylsulfanylphenyl)ethanamide Openeye Name: 2-(4-isopropylsulfanylphenyl)-N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]acetamide CAS Name: N-[2-(4-methylsulfonyl-1-piperazinyl)ethyl]-2-[4-(propan-2-ylthio)phenyl]acetamide IUPAC Name: N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]-2-(4-propan-2-ylsulfanylphenyl)acetamide Traditional Name: 2-[4-(isopropylthio)phenyl]-N-[2-(4-mesylpiperazino)ethyl]acetamide Formula: C18H29N3O3S2 MolecularWeight: 399.57116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)CC(=O)NCCN2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)CC(=O)NCCN2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C18H29N3O3S2/c1-15(2)25-17-6-4-16(5-7-17)14-18(22)19-8-9-20-10-12-21(13-11-20)26(3,23)24/h4-7,15H,8-14H2,1-3H3,(H,19,22)