[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: [1-benzyl-3-(2-thienyl)pyrazol-4-yl]-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: [1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (1-benzyl-3-thiophen-2-ylpyrazol-4-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: [1-benzyl-3-(2-thienyl)pyrazol-4-yl]-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C23H22N4O3S3 MolecularWeight: 498.64078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C23H22N4O3S3/c28-23(25-10-12-27(13-11-25)33(29,30)21-9-5-15-32-21)19-17-26(16-18-6-2-1-3-7-18)24-22(19)20-8-4-14-31-20/h1-9,14-15,17H,10-13,16H2