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

Systemtic Name: 1-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-methyl-thiourea Openeye Name: 1-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-methyl-thiourea CAS Name: 1-[1-[(4-bromophenyl)methyl]-3-pyrazolyl]-3-methylthiourea IUPAC Name: 1-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-methylthiourea Traditional Name: 1-[1-(4-bromobenzyl)pyrazol-3-yl]-3-methyl-thiourea Formula: C12H13BrN4S MolecularWeight: 325.22742

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=NN(C=C1)CC2=CC=C(C=C2)Br

Isomeric SMILES

CNC(=S)NC1=NN(C=C1)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C12H13BrN4S/c1-14-12(18)15-11-6-7-17(16-11)8-9-2-4-10(13)5-3-9/h2-7H,8H2,1H3,(H2,14,15,16,18)