1-[2-(4-chloranylpyrazol-1-yl)ethyl]-3-(4-ethanoylphenyl)thiourea

Systemtic Name: 1-[2-(4-chloranylpyrazol-1-yl)ethyl]-3-(4-ethanoylphenyl)thiourea Openeye Name: 1-(4-acetylphenyl)-3-[2-(4-chloropyrazol-1-yl)ethyl]thiourea CAS Name: 1-(4-acetylphenyl)-3-[2-(4-chloro-1-pyrazolyl)ethyl]thiourea IUPAC Name: 1-(4-acetylphenyl)-3-[2-(4-chloropyrazol-1-yl)ethyl]thiourea Traditional Name: 1-(4-acetylphenyl)-3-[2-(4-chloropyrazol-1-yl)ethyl]thiourea Formula: C14H15ClN4OS MolecularWeight: 322.8131

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=S)NCCN2C=C(C=N2)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=S)NCCN2C=C(C=N2)Cl

InChI

InChI=1S/C14H15ClN4OS/c1-10(20)11-2-4-13(5-3-11)18-14(21)16-6-7-19-9-12(15)8-17-19/h2-5,8-9H,6-7H2,1H3,(H2,16,18,21)