[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-[1-(phenylmethyl)pyrazol-4-yl]methanone

Systemtic Name: [4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-[1-(phenylmethyl)pyrazol-4-yl]methanone Openeye Name: (1-benzylpyrazol-4-yl)-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]methanone CAS Name: [4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-[1-(phenylmethyl)-4-pyrazolyl]methanone IUPAC Name: (1-benzylpyrazol-4-yl)-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]methanone Traditional Name: (1-benzylpyrazol-4-yl)-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]methanone Formula: C19H19BrN4O3S2 MolecularWeight: 495.41316

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CN(N=C2)CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

C1CN(CCN1C(=O)C2=CN(N=C2)CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C19H19BrN4O3S2/c20-17-6-7-18(28-17)29(26,27)24-10-8-22(9-11-24)19(25)16-12-21-23(14-16)13-15-4-2-1-3-5-15/h1-7,12,14H,8-11,13H2