1-(4-bromophenyl)-3-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]thiourea

Systemtic Name: 1-(4-bromophenyl)-3-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]thiourea Openeye Name: 1-(4-bromophenyl)-3-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]thiourea CAS Name: 1-(4-bromophenyl)-3-[1-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]thiourea IUPAC Name: 1-(4-bromophenyl)-3-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]thiourea Traditional Name: 1-(4-bromophenyl)-3-[1-(2,4-dichlorobenzyl)pyrazol-3-yl]thiourea Formula: C17H13BrCl2N4S MolecularWeight: 456.18692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC2=NN(C=C2)CC3=C(C=C(C=C3)Cl)Cl)Br

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC2=NN(C=C2)CC3=C(C=C(C=C3)Cl)Cl)Br

InChI

InChI=1S/C17H13BrCl2N4S/c18-12-2-5-14(6-3-12)21-17(25)22-16-7-8-24(23-16)10-11-1-4-13(19)9-15(11)20/h1-9H,10H2,(H2,21,22,23,25)