[4-(2,4-dimethylphenyl)piperazin-1-yl]-[5-methyl-1-(4-thiophen-2-ylpyrimidin-2-yl)pyrazol-4-yl]methanone

Systemtic Name: [4-(2,4-dimethylphenyl)piperazin-1-yl]-[5-methyl-1-(4-thiophen-2-ylpyrimidin-2-yl)pyrazol-4-yl]methanone Openeye Name: [4-(2,4-dimethylphenyl)piperazin-1-yl]-[5-methyl-1-[4-(2-thienyl)pyrimidin-2-yl]pyrazol-4-yl]methanone CAS Name: [4-(2,4-dimethylphenyl)-1-piperazinyl]-[5-methyl-1-(4-thiophen-2-yl-2-pyrimidinyl)-4-pyrazolyl]methanone IUPAC Name: [4-(2,4-dimethylphenyl)piperazin-1-yl]-[5-methyl-1-(4-thiophen-2-ylpyrimidin-2-yl)pyrazol-4-yl]methanone Traditional Name: [4-(2,4-dimethylphenyl)piperazino]-[5-methyl-1-[4-(2-thienyl)pyrimidin-2-yl]pyrazol-4-yl]methanone Formula: C25H26N6OS MolecularWeight: 458.57854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(N(N=C3)C4=NC=CC(=N4)C5=CC=CS5)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(N(N=C3)C4=NC=CC(=N4)C5=CC=CS5)C)C

InChI

InChI=1S/C25H26N6OS/c1-17-6-7-22(18(2)15-17)29-10-12-30(13-11-29)24(32)20-16-27-31(19(20)3)25-26-9-8-21(28-25)23-5-4-14-33-23/h4-9,14-16H,10-13H2,1-3H3