4-[1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-5-methyl-pyrazol-4-yl]carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-[1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-5-methyl-pyrazol-4-yl]carbonylpiperazine-1-carbaldehyde Openeye Name: 4-[1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]-5-methyl-pyrazole-4-carbonyl]piperazine-1-carbaldehyde CAS Name: 4-[[1-[4-(2,5-dimethyl-3-thiophenyl)-2-pyrimidinyl]-5-methyl-4-pyrazolyl]-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-5-methylpyrazole-4-carbonyl]piperazine-1-carbaldehyde Traditional Name: 4-[1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]-5-methyl-pyrazole-4-carbonyl]piperazine-1-carbaldehyde Formula: C20H22N6O2S MolecularWeight: 410.49268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N4CCN(CC4)C=O)C

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N4CCN(CC4)C=O)C

InChI

InChI=1S/C20H22N6O2S/c1-13-10-16(15(3)29-13)18-4-5-21-20(23-18)26-14(2)17(11-22-26)19(28)25-8-6-24(12-27)7-9-25/h4-5,10-12H,6-9H2,1-3H3