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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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