2-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-5-methyl-isoindole-1,3-dione

Systemtic Name: 2-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-5-methyl-isoindole-1,3-dione Openeye Name: 2-[2-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]-2-oxo-ethyl]-5-methyl-isoindoline-1,3-dione CAS Name: 2-[2-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-2-oxoethyl]-5-methylisoindole-1,3-dione IUPAC Name: 2-[2-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]-2-oxoethyl]-5-methylisoindole-1,3-dione Traditional Name: 2-[2-[4-[(5-chloro-2-thienyl)methyl]piperazino]-2-keto-ethyl]-5-methyl-isoindoline-1,3-quinone Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CC(=O)N3CCN(CC3)CC4=CC=C(S4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CC(=O)N3CCN(CC3)CC4=CC=C(S4)Cl

InChI

InChI=1S/C20H20ClN3O3S/c1-13-2-4-15-16(10-13)20(27)24(19(15)26)12-18(25)23-8-6-22(7-9-23)11-14-3-5-17(21)28-14/h2-5,10H,6-9,11-12H2,1H3