1-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(5-methylthiophen-2-yl)sulfonyl-piperazine

Systemtic Name: 1-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(5-methylthiophen-2-yl)sulfonyl-piperazine Openeye Name: 1-[(5-bromo-2-methoxy-phenyl)methyl]-4-[(5-methyl-2-thienyl)sulfonyl]piperazine CAS Name: 1-[(5-bromo-2-methoxyphenyl)methyl]-4-[(5-methyl-2-thiophenyl)sulfonyl]piperazine IUPAC Name: 1-[(5-bromo-2-methoxyphenyl)methyl]-4-(5-methylthiophen-2-yl)sulfonylpiperazine Traditional Name: 1-(5-bromo-2-methoxy-benzyl)-4-[(5-methyl-2-thienyl)sulfonyl]piperazine Formula: C17H21BrN2O3S2 MolecularWeight: 445.39424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C17H21BrN2O3S2/c1-13-3-6-17(24-13)25(21,22)20-9-7-19(8-10-20)12-14-11-15(18)4-5-16(14)23-2/h3-6,11H,7-10,12H2,1-2H3