N-(2-carbamothioylphenyl)-4-pyrazol-1-yl-butanamide

Systemtic Name: N-(2-carbamothioylphenyl)-4-pyrazol-1-yl-butanamide Openeye Name: N-(2-carbamothioylphenyl)-4-pyrazol-1-yl-butanamide CAS Name: N-(2-carbamothioylphenyl)-4-(1-pyrazolyl)butanamide IUPAC Name: N-(2-carbamothioylphenyl)-4-pyrazol-1-ylbutanamide Traditional Name: 4-pyrazol-1-yl-N-(2-thiocarbamoylphenyl)butyramide Formula: C14H16N4OS MolecularWeight: 288.36804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=S)N)NC(=O)CCCN2C=CC=N2

Isomeric SMILES

C1=CC=C(C(=C1)C(=S)N)NC(=O)CCCN2C=CC=N2

InChI

InChI=1S/C14H16N4OS/c15-14(20)11-5-1-2-6-12(11)17-13(19)7-3-9-18-10-4-8-16-18/h1-2,4-6,8,10H,3,7,9H2,(H2,15,20)(H,17,19)