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

Systemtic Name: 1-(4-bromophenyl)-3-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]thiourea Openeye Name: 1-(4-bromophenyl)-3-[1-(o-tolylmethyl)pyrazol-3-yl]thiourea CAS Name: 1-(4-bromophenyl)-3-[1-[(2-methylphenyl)methyl]-3-pyrazolyl]thiourea IUPAC Name: 1-(4-bromophenyl)-3-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]thiourea Traditional Name: 1-(4-bromophenyl)-3-[1-(2-methylbenzyl)pyrazol-3-yl]thiourea Formula: C18H17BrN4S MolecularWeight: 401.32338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC(=N2)NC(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC(=N2)NC(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN4S/c1-13-4-2-3-5-14(13)12-23-11-10-17(22-23)21-18(24)20-16-8-6-15(19)7-9-16/h2-11H,12H2,1H3,(H2,20,21,22,24)