N-(3-carbamothioylphenyl)-4-pyrazol-1-yl-butanamide

Systemtic Name: N-(3-carbamothioylphenyl)-4-pyrazol-1-yl-butanamide Openeye Name: N-(3-carbamothioylphenyl)-4-pyrazol-1-yl-butanamide CAS Name: N-(3-carbamothioylphenyl)-4-(1-pyrazolyl)butanamide IUPAC Name: N-(3-carbamothioylphenyl)-4-pyrazol-1-ylbutanamide Traditional Name: 4-pyrazol-1-yl-N-(3-thiocarbamoylphenyl)butyramide Formula: C14H16N4OS MolecularWeight: 288.36804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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