1-(3-ethanoylphenyl)-3-[1-(phenylmethyl)pyrazol-4-yl]thiourea

Systemtic Name: 1-(3-ethanoylphenyl)-3-[1-(phenylmethyl)pyrazol-4-yl]thiourea Openeye Name: 1-(3-acetylphenyl)-3-(1-benzylpyrazol-4-yl)thiourea CAS Name: 1-(3-acetylphenyl)-3-[1-(phenylmethyl)-4-pyrazolyl]thiourea IUPAC Name: 1-(3-acetylphenyl)-3-(1-benzylpyrazol-4-yl)thiourea Traditional Name: 1-(3-acetylphenyl)-3-(1-benzylpyrazol-4-yl)thiourea Formula: C19H18N4OS MolecularWeight: 350.43742

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H18N4OS/c1-14(24)16-8-5-9-17(10-16)21-19(25)22-18-11-20-23(13-18)12-15-6-3-2-4-7-15/h2-11,13H,12H2,1H3,(H2,21,22,25)