3-methyl-2-[4-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]phenyl]-1H-pyrazol-5-one

Systemtic Name: 3-methyl-2-[4-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]phenyl]-1H-pyrazol-5-one Openeye Name: 3-methyl-2-[4-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]phenyl]-1H-pyrazol-5-one CAS Name: 3-methyl-2-[4-[(6-phenyl-4-thieno[3,2-d]pyrimidinyl)amino]phenyl]-1H-pyrazol-5-one IUPAC Name: 3-methyl-2-[4-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]phenyl]-1H-pyrazol-5-one Traditional Name: 5-methyl-1-[4-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]phenyl]-3-pyrazolin-3-one Formula: C22H17N5OS MolecularWeight: 399.46828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NN1C2=CC=C(C=C2)NC3=NC=NC4=C3SC(=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=O)NN1C2=CC=C(C=C2)NC3=NC=NC4=C3SC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C22H17N5OS/c1-14-11-20(28)26-27(14)17-9-7-16(8-10-17)25-22-21-18(23-13-24-22)12-19(29-21)15-5-3-2-4-6-15/h2-13H,1H3,(H,26,28)(H,23,24,25)