N-[2-(3-methoxypiperazin-1-yl)-4-propan-2-ylsulfonyl-phenyl]sulfamoyl bromide

Systemtic Name: N-[2-(3-methoxypiperazin-1-yl)-4-propan-2-ylsulfonyl-phenyl]sulfamoyl bromide Openeye Name: N-[4-isopropylsulfonyl-2-(3-methoxypiperazin-1-yl)phenyl]sulfamoyl bromide CAS Name: N-[2-(3-methoxy-1-piperazinyl)-4-propan-2-ylsulfonylphenyl]sulfamoyl bromide IUPAC Name: N-[2-(3-methoxypiperazin-1-yl)-4-propan-2-ylsulfonylphenyl]sulfamoyl bromide Traditional Name: N-[4-isopropylsulfonyl-2-(3-methoxypiperazino)phenyl]sulfamoyl bromide Formula: C14H22BrN3O5S2 MolecularWeight: 456.37558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC(=C(C=C1)NS(=O)(=O)Br)N2CCNC(C2)OC

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC(=C(C=C1)NS(=O)(=O)Br)N2CCNC(C2)OC

InChI

InChI=1S/C14H22BrN3O5S2/c1-10(2)24(19,20)11-4-5-12(17-25(15,21)22)13(8-11)18-7-6-16-14(9-18)23-3/h4-5,8,10,14,16-17H,6-7,9H2,1-3H3