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

Systemtic Name: 1-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-(3-methylphenyl)thiourea Openeye Name: 1-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-(m-tolyl)thiourea CAS Name: 1-[1-[(4-bromophenyl)methyl]-3-pyrazolyl]-3-(3-methylphenyl)thiourea IUPAC Name: 1-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-(3-methylphenyl)thiourea Traditional Name: 1-[1-(4-bromobenzyl)pyrazol-3-yl]-3-(m-tolyl)thiourea Formula: C18H17BrN4S MolecularWeight: 401.32338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NC2=NN(C=C2)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NC2=NN(C=C2)CC3=CC=C(C=C3)Br

InChI

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