3-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]thieno[2,3-d]pyrimidin-4-one Formula: C17H13ClN4OS MolecularWeight: 356.82932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN2C=NC3=C(C2=O)C=CS3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1CN2C=NC3=C(C2=O)C=CS3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C17H13ClN4OS/c1-11-14(15(18)22(20-11)12-5-3-2-4-6-12)9-21-10-19-16-13(17(21)23)7-8-24-16/h2-8,10H,9H2,1H3