1-[4-(4-chlorophenyl)-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]thiourea

Systemtic Name: 1-[4-(4-chlorophenyl)-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]thiourea Openeye Name: [4-(4-chlorophenyl)-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]thiourea CAS Name: [4-(4-chlorophenyl)-3-methyl-1-phenyl-6-pyrazolo[3,4-d]pyrimidinyl]thiourea IUPAC Name: [4-(4-chlorophenyl)-3-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-6-yl]thiourea Traditional Name: [4-(4-chlorophenyl)-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]thiourea Formula: C19H15ClN6S MolecularWeight: 394.8806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC(=NC(=C12)C3=CC=C(C=C3)Cl)NC(=S)N)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=NC(=NC(=C12)C3=CC=C(C=C3)Cl)NC(=S)N)C4=CC=CC=C4

InChI

InChI=1S/C19H15ClN6S/c1-11-15-16(12-7-9-13(20)10-8-12)22-19(24-18(21)27)23-17(15)26(25-11)14-5-3-2-4-6-14/h2-10H,1H3,(H3,21,22,23,24,27)