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

Systemtic Name: [4-[3-(4-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]carbonylpiperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[1-benzyl-3-(4-methoxyphenyl)pyrazole-4-carbonyl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[[3-(4-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[1-benzyl-3-(4-methoxyphenyl)pyrazole-4-carbonyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[1-benzyl-3-(4-methoxyphenyl)pyrazole-4-carbonyl]piperazino]-(2-thienyl)methanone Formula: C27H26N4O3S MolecularWeight: 486.58534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)N3CCN(CC3)C(=O)C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)N3CCN(CC3)C(=O)C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C27H26N4O3S/c1-34-22-11-9-21(10-12-22)25-23(19-31(28-25)18-20-6-3-2-4-7-20)26(32)29-13-15-30(16-14-29)27(33)24-8-5-17-35-24/h2-12,17,19H,13-16,18H2,1H3