methyl 1-[[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]methyl]indazole-5-carboxylate

Systemtic Name: methyl 1-[[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]methyl]indazole-5-carboxylate Openeye Name: methyl 1-[[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]methyl]indazole-5-carboxylate CAS Name: 1-[[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]methyl]-5-indazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]methyl]indazole-5-carboxylate Traditional Name: 1-[[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]methyl]indazole-5-carboxylic acid methyl ester Formula: C18H19BrN4O4S2 MolecularWeight: 499.40186

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(N=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(N=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C18H19BrN4O4S2/c1-27-18(24)13-2-3-15-14(10-13)11-20-23(15)12-21-6-8-22(9-7-21)29(25,26)17-5-4-16(19)28-17/h2-5,10-11H,6-9,12H2,1H3