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

Systemtic Name: 2-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-3-methyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-3-methyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylthio]-3-methyl-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylsulfanyl]-3-methylthieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylthio]-3-methyl-thieno[3,2-d]pyrimidin-4-one Formula: C18H15ClN4OS2 MolecularWeight: 402.9209

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CSC2=NC3=C(C(=O)N2C)SC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1CSC2=NC3=C(C(=O)N2C)SC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C18H15ClN4OS2/c1-11-13(16(19)23(21-11)12-6-4-3-5-7-12)10-26-18-20-14-8-9-25-15(14)17(24)22(18)2/h3-9H,10H2,1-2H3