1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-(1H-indol-3-yl)butan-1-one

Systemtic Name: 1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-(1H-indol-3-yl)butan-1-one Openeye Name: 1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-4-(1H-indol-3-yl)butan-1-one CAS Name: 1-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-4-(1H-indol-3-yl)-1-butanone IUPAC Name: 1-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-4-(1H-indol-3-yl)butan-1-one Traditional Name: 1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-4-(1H-indol-3-yl)butan-1-one Formula: C20H22ClN3O3S2 MolecularWeight: 451.98998

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCC2=CNC3=CC=CC=C32)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CCCC2=CNC3=CC=CC=C32)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C20H22ClN3O3S2/c21-18-8-9-20(28-18)29(26,27)24-12-10-23(11-13-24)19(25)7-3-4-15-14-22-17-6-2-1-5-16(15)17/h1-2,5-6,8-9,14,22H,3-4,7,10-13H2