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

Systemtic Name: N-chloranyl-2-(3-methoxypiperazin-1-yl)-2-(4-propan-2-ylsulfonylphenyl)ethanamine Openeye Name: N-chloro-2-(4-isopropylsulfonylphenyl)-2-(3-methoxypiperazin-1-yl)ethanamine CAS Name: N-chloro-2-(3-methoxy-1-piperazinyl)-2-(4-propan-2-ylsulfonylphenyl)ethanamine IUPAC Name: N-chloro-2-(3-methoxypiperazin-1-yl)-2-(4-propan-2-ylsulfonylphenyl)ethanamine Traditional Name: chloro-[2-(4-isopropylsulfonylphenyl)-2-(3-methoxypiperazino)ethyl]amine Formula: C16H26ClN3O3S MolecularWeight: 375.91394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26ClN3O3S/c1-12(2)24(21,22)14-6-4-13(5-7-14)15(10-19-17)20-9-8-18-16(11-20)23-3/h4-7,12,15-16,18-19H,8-11H2,1-3H3