[2-[[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazol-5-yl]-piperidin-1-yl-methanone

Systemtic Name: [2-[[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazol-5-yl]-piperidin-1-yl-methanone Openeye Name: [2-[[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]methyl]-1,3-benzoxazol-5-yl]-(1-piperidyl)methanone CAS Name: [2-[[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]methyl]-1,3-benzoxazol-5-yl]-(1-piperidinyl)methanone IUPAC Name: [2-[[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]methyl]-1,3-benzoxazol-5-yl]-piperidin-1-ylmethanone Traditional Name: [2-[[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]methyl]-1,3-benzoxazol-5-yl]-piperidino-methanone Formula: C22H25BrN4O4S2 MolecularWeight: 553.4923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC3=C(C=C2)OC(=N3)CN4CCN(CC4)S(=O)(=O)C5=CC=C(S5)Br

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC3=C(C=C2)OC(=N3)CN4CCN(CC4)S(=O)(=O)C5=CC=C(S5)Br

InChI

InChI=1S/C22H25BrN4O4S2/c23-19-6-7-21(32-19)33(29,30)27-12-10-25(11-13-27)15-20-24-17-14-16(4-5-18(17)31-20)22(28)26-8-2-1-3-9-26/h4-7,14H,1-3,8-13,15H2