1-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-methyl-thiourea

Systemtic Name: 1-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-methyl-thiourea Openeye Name: 1-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-methyl-thiourea CAS Name: 1-[4-bromo-1-[(3,4-dichlorophenyl)methyl]-3-pyrazolyl]-3-methylthiourea IUPAC Name: 1-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-methylthiourea Traditional Name: 1-[4-bromo-1-(3,4-dichlorobenzyl)pyrazol-3-yl]-3-methyl-thiourea Formula: C12H11BrCl2N4S MolecularWeight: 394.11754

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=NN(C=C1Br)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CNC(=S)NC1=NN(C=C1Br)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C12H11BrCl2N4S/c1-16-12(20)17-11-8(13)6-19(18-11)5-7-2-3-9(14)10(15)4-7/h2-4,6H,5H2,1H3,(H2,16,17,18,20)