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

Systemtic Name: 1-[2-(4-chloranylpyrazol-1-yl)ethyl]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[2-(4-chloropyrazol-1-yl)ethyl]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[2-(4-chloro-1-pyrazolyl)ethyl]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[2-(4-chloropyrazol-1-yl)ethyl]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[2-(4-chloropyrazol-1-yl)ethyl]-3-(3-methoxyphenyl)thiourea Formula: C13H15ClN4OS MolecularWeight: 310.8024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NCCN2C=C(C=N2)Cl

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NCCN2C=C(C=N2)Cl

InChI

InChI=1S/C13H15ClN4OS/c1-19-12-4-2-3-11(7-12)17-13(20)15-5-6-18-9-10(14)8-16-18/h2-4,7-9H,5-6H2,1H3,(H2,15,17,20)