1-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(2-ethylphenyl)thiourea

Systemtic Name: 1-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(2-ethylphenyl)thiourea Openeye Name: 1-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(2-ethylphenyl)thiourea CAS Name: 1-[4-bromo-1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-3-(2-ethylphenyl)thiourea IUPAC Name: 1-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(2-ethylphenyl)thiourea Traditional Name: 1-[4-bromo-1-(2-chlorobenzyl)pyrazol-3-yl]-3-(2-ethylphenyl)thiourea Formula: C19H18BrClN4S MolecularWeight: 449.79502

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NC2=NN(C=C2Br)CC3=CC=CC=C3Cl

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NC2=NN(C=C2Br)CC3=CC=CC=C3Cl

InChI

InChI=1S/C19H18BrClN4S/c1-2-13-7-4-6-10-17(13)22-19(26)23-18-15(20)12-25(24-18)11-14-8-3-5-9-16(14)21/h3-10,12H,2,11H2,1H3,(H2,22,23,24,26)