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

Systemtic Name: [1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [1-benzyl-3-(2-thienyl)pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (1-benzyl-3-thiophen-2-ylpyrazol-4-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: [1-benzyl-3-(2-thienyl)pyrazol-4-yl]-(4-phenylpiperazino)methanone Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C25H24N4OS/c30-25(28-15-13-27(14-16-28)21-10-5-2-6-11-21)22-19-29(18-20-8-3-1-4-9-20)26-24(22)23-12-7-17-31-23/h1-12,17,19H,13-16,18H2