1-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]-3-(2-bromanyl-4-methyl-phenoxy)propan-1-one

Systemtic Name: 1-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]-3-(2-bromanyl-4-methyl-phenoxy)propan-1-one Openeye Name: 1-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]-3-(2-bromo-4-methyl-phenoxy)propan-1-one CAS Name: 1-[4-(4-aminophenyl)sulfonyl-1-piperazinyl]-3-(2-bromo-4-methylphenoxy)-1-propanone IUPAC Name: 1-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]-3-(2-bromo-4-methylphenoxy)propan-1-one Traditional Name: 3-(2-bromo-4-methyl-phenoxy)-1-(4-sulfanilylpiperazino)propan-1-one Formula: C20H24BrN3O4S MolecularWeight: 482.39126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)N)Br

InChI

InChI=1S/C20H24BrN3O4S/c1-15-2-7-19(18(21)14-15)28-13-8-20(25)23-9-11-24(12-10-23)29(26,27)17-5-3-16(22)4-6-17/h2-7,14H,8-13,22H2,1H3