[3-methyl-1-(phenylmethyl)thieno[2,3-c]pyrazol-5-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [3-methyl-1-(phenylmethyl)thieno[2,3-c]pyrazol-5-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (1-benzyl-3-methyl-thieno[2,3-c]pyrazol-5-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [3-methyl-1-(phenylmethyl)-5-thieno[2,3-c]pyrazolyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (1-benzyl-3-methylthieno[2,3-c]pyrazol-5-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (1-benzyl-3-methyl-thieno[2,3-c]pyrazol-5-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C22H22N6OS MolecularWeight: 418.51468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)N3CCN(CC3)C4=NC=CC=N4)CC5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)N3CCN(CC3)C4=NC=CC=N4)CC5=CC=CC=C5

InChI

InChI=1S/C22H22N6OS/c1-16-18-14-19(30-21(18)28(25-16)15-17-6-3-2-4-7-17)20(29)26-10-12-27(13-11-26)22-23-8-5-9-24-22/h2-9,14H,10-13,15H2,1H3