5-azanyl-7-(2-chlorophenyl)-N-(4-chlorophenyl)-6-cyano-2-phenylazanyl-pyrazolo[1,5-a]pyrimidine-3-carbothioamide

Systemtic Name: 5-azanyl-7-(2-chlorophenyl)-N-(4-chlorophenyl)-6-cyano-2-phenylazanyl-pyrazolo[1,5-a]pyrimidine-3-carbothioamide Openeye Name: 5-amino-2-anilino-7-(2-chlorophenyl)-N-(4-chlorophenyl)-6-cyano-pyrazolo[1,5-a]pyrimidine-3-carbothioamide CAS Name: 5-amino-2-anilino-7-(2-chlorophenyl)-N-(4-chlorophenyl)-6-cyano-3-pyrazolo[1,5-a]pyrimidinecarbothioamide IUPAC Name: 5-amino-2-anilino-7-(2-chlorophenyl)-N-(4-chlorophenyl)-6-cyanopyrazolo[1,5-a]pyrimidine-3-carbothioamide Traditional Name: 5-amino-2-anilino-7-(2-chlorophenyl)-N-(4-chlorophenyl)-6-cyano-pyrazolo[1,5-a]pyrimidine-3-carbothioamide Formula: C26H17Cl2N7S MolecularWeight: 530.43108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN3C(=C(C(=NC3=C2C(=S)NC4=CC=C(C=C4)Cl)N)C#N)C5=CC=CC=C5Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN3C(=C(C(=NC3=C2C(=S)NC4=CC=C(C=C4)Cl)N)C#N)C5=CC=CC=C5Cl

InChI

InChI=1S/C26H17Cl2N7S/c27-15-10-12-17(13-11-15)32-26(36)21-24(31-16-6-2-1-3-7-16)34-35-22(18-8-4-5-9-20(18)28)19(14-29)23(30)33-25(21)35/h1-13H,(H2,30,33)(H,31,34)(H,32,36)