2-[2,3-bis(chloranyl)-4-(2-methoxyphenyl)sulfanyl-phenyl]-1-piperazin-1-yl-prop-2-en-1-one

Systemtic Name: 2-[2,3-bis(chloranyl)-4-(2-methoxyphenyl)sulfanyl-phenyl]-1-piperazin-1-yl-prop-2-en-1-one Openeye Name: 2-[2,3-dichloro-4-(2-methoxyphenyl)sulfanyl-phenyl]-1-piperazin-1-yl-prop-2-en-1-one CAS Name: 2-[2,3-dichloro-4-[(2-methoxyphenyl)thio]phenyl]-1-(1-piperazinyl)-2-propen-1-one IUPAC Name: 2-[2,3-dichloro-4-(2-methoxyphenyl)sulfanylphenyl]-1-piperazin-1-ylprop-2-en-1-one Traditional Name: 2-[2,3-dichloro-4-[(2-methoxyphenyl)thio]phenyl]-1-piperazino-prop-2-en-1-one Formula: C20H20Cl2N2O2S MolecularWeight: 423.356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1SC2=C(C(=C(C=C2)C(=C)C(=O)N3CCNCC3)Cl)Cl

Isomeric SMILES

COC1=CC=CC=C1SC2=C(C(=C(C=C2)C(=C)C(=O)N3CCNCC3)Cl)Cl

InChI

InChI=1S/C20H20Cl2N2O2S/c1-13(20(25)24-11-9-23-10-12-24)14-7-8-17(19(22)18(14)21)27-16-6-4-3-5-15(16)26-2/h3-8,23H,1,9-12H2,2H3