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

Systemtic Name: 1-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-3-(4-ethoxyphenyl)thiourea Openeye Name: 1-(1-benzyl-4-chloro-pyrazol-3-yl)-3-(4-ethoxyphenyl)thiourea CAS Name: 1-[4-chloro-1-(phenylmethyl)-3-pyrazolyl]-3-(4-ethoxyphenyl)thiourea IUPAC Name: 1-(1-benzyl-4-chloropyrazol-3-yl)-3-(4-ethoxyphenyl)thiourea Traditional Name: 1-(1-benzyl-4-chloro-pyrazol-3-yl)-3-p-phenetyl-thiourea Formula: C19H19ClN4OS MolecularWeight: 386.89836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NC2=NN(C=C2Cl)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC2=NN(C=C2Cl)CC3=CC=CC=C3

InChI

InChI=1S/C19H19ClN4OS/c1-2-25-16-10-8-15(9-11-16)21-19(26)22-18-17(20)13-24(23-18)12-14-6-4-3-5-7-14/h3-11,13H,2,12H2,1H3,(H2,21,22,23,26)