4-bromanyl-N-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethyl]benzamide hydrochloride

Systemtic Name: 4-bromanyl-N-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethyl]benzamide hydrochloride Openeye Name: 4-bromo-N-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethyl]benzamide hydrochloride CAS Name: 4-bromo-N-[2-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]ethyl]benzamide hydrochloride IUPAC Name: 4-bromo-N-[2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethyl]benzamide hydrochloride Traditional Name: 4-bromo-N-[2-[4-(4-methoxyphenyl)sulfonylpiperazino]ethyl]benzamide hydrochloride Formula: C20H25BrClN3O4S MolecularWeight: 518.8522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)Br.Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)Br.Cl

InChI

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