[1-(5-bromanylthiophen-2-yl)sulfonylpiperidin-3-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [1-(5-bromanylthiophen-2-yl)sulfonylpiperidin-3-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [1-[(5-bromo-2-thienyl)sulfonyl]-3-piperidyl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [1-[(5-bromo-2-thiophenyl)sulfonyl]-3-piperidinyl]-[4-(3-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [1-(5-bromothiophen-2-yl)sulfonylpiperidin-3-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [1-[(5-bromo-2-thienyl)sulfonyl]-3-piperidyl]-[4-(3-methoxyphenyl)piperazino]methanone Formula: C21H26BrN3O4S2 MolecularWeight: 528.48284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C21H26BrN3O4S2/c1-29-18-6-2-5-17(14-18)23-10-12-24(13-11-23)21(26)16-4-3-9-25(15-16)31(27,28)20-8-7-19(22)30-20/h2,5-8,14,16H,3-4,9-13,15H2,1H3