1-(5-chloranyl-6-methoxy-naphthalen-2-yl)-2-[4-[2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl]piperazin-1-yl]propan-1-one

Systemtic Name: 1-(5-chloranyl-6-methoxy-naphthalen-2-yl)-2-[4-[2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl]piperazin-1-yl]propan-1-one Openeye Name: 1-(5-chloro-6-methoxy-2-naphthyl)-2-[4-[2-(4-methylsulfonylphenyl)-2-oxo-ethyl]piperazin-1-yl]propan-1-one CAS Name: 1-(5-chloro-6-methoxy-2-naphthalenyl)-2-[4-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-(5-chloro-6-methoxynaphthalen-2-yl)-2-[4-[2-(4-methylsulfonylphenyl)-2-oxoethyl]piperazin-1-yl]propan-1-one Traditional Name: 1-(5-chloro-6-methoxy-2-naphthyl)-2-[4-[2-keto-2-(4-mesylphenyl)ethyl]piperazino]propan-1-one Formula: C27H29ClN2O5S MolecularWeight: 529.04756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(C=C1)C(=C(C=C2)OC)Cl)N3CCN(CC3)CC(=O)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)C1=CC2=C(C=C1)C(=C(C=C2)OC)Cl)N3CCN(CC3)CC(=O)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C27H29ClN2O5S/c1-18(27(32)21-6-10-23-20(16-21)7-11-25(35-2)26(23)28)30-14-12-29(13-15-30)17-24(31)19-4-8-22(9-5-19)36(3,33)34/h4-11,16,18H,12-15,17H2,1-3H3