N-[(4-pentylphenyl)carbamothioyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide

Systemtic Name: N-[(4-pentylphenyl)carbamothioyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide Openeye Name: N-[(4-pentylphenyl)carbamothioyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide CAS Name: N-[(4-pentylanilino)-sulfanylidenemethyl]-6-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-[(4-pentylphenyl)carbamothioyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide Traditional Name: N-[(4-amylphenyl)thiocarbamoyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CN3C(=CC=N3)N=C2

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CN3C(=CC=N3)N=C2

InChI

InChI=1S/C19H21N5OS/c1-2-3-4-5-14-6-8-16(9-7-14)22-19(26)23-18(25)15-12-20-17-10-11-21-24(17)13-15/h6-13H,2-5H2,1H3,(H2,22,23,25,26)