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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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