2-(3-methoxypiperazin-1-yl)-N-methylsulfanyl-2-(4-propan-2-ylsulfonylphenyl)ethanamine

Systemtic Name: 2-(3-methoxypiperazin-1-yl)-N-methylsulfanyl-2-(4-propan-2-ylsulfonylphenyl)ethanamine Openeye Name: 2-(4-isopropylsulfonylphenyl)-2-(3-methoxypiperazin-1-yl)-N-methylsulfanyl-ethanamine CAS Name: N-[2-(3-methoxy-1-piperazinyl)-2-(4-propan-2-ylsulfonylphenyl)ethyl]methanesulfenamide IUPAC Name: 2-(3-methoxypiperazin-1-yl)-N-methylsulfanyl-2-(4-propan-2-ylsulfonylphenyl)ethanamine Traditional Name: [2-(4-isopropylsulfonylphenyl)-2-(3-methoxypiperazino)ethyl]-(methylthio)amine Formula: C17H29N3O3S2 MolecularWeight: 387.56046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(CNSC)N2CCNC(C2)OC

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(CNSC)N2CCNC(C2)OC

InChI

InChI=1S/C17H29N3O3S2/c1-13(2)25(21,22)15-7-5-14(6-8-15)16(11-19-24-4)20-10-9-18-17(12-20)23-3/h5-8,13,16-19H,9-12H2,1-4H3