1-[3-(1-tert-butyl-5-thiophen-2-yl-pyrazol-3-yl)propyl]-4-(3,4-dimethylphenyl)piperazine

Systemtic Name: 1-[3-(1-tert-butyl-5-thiophen-2-yl-pyrazol-3-yl)propyl]-4-(3,4-dimethylphenyl)piperazine Openeye Name: 1-[3-[1-tert-butyl-5-(2-thienyl)pyrazol-3-yl]propyl]-4-(3,4-dimethylphenyl)piperazine CAS Name: 1-[3-(1-tert-butyl-5-thiophen-2-yl-3-pyrazolyl)propyl]-4-(3,4-dimethylphenyl)piperazine IUPAC Name: 1-[3-(1-tert-butyl-5-thiophen-2-ylpyrazol-3-yl)propyl]-4-(3,4-dimethylphenyl)piperazine Traditional Name: 1-[3-[1-tert-butyl-5-(2-thienyl)pyrazol-3-yl]propyl]-4-(3,4-dimethylphenyl)piperazine Formula: C26H36N4S MolecularWeight: 436.65584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)CCCC3=NN(C(=C3)C4=CC=CS4)C(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)CCCC3=NN(C(=C3)C4=CC=CS4)C(C)(C)C)C

InChI

InChI=1S/C26H36N4S/c1-20-10-11-23(18-21(20)2)29-15-13-28(14-16-29)12-6-8-22-19-24(25-9-7-17-31-25)30(27-22)26(3,4)5/h7,9-11,17-19H,6,8,12-16H2,1-5H3