1-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-[(4-chlorophenyl)methyl]thiourea

Systemtic Name: 1-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-[(4-chlorophenyl)methyl]thiourea Openeye Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-[(4-chlorophenyl)methyl]thiourea CAS Name: 1-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-3-[(4-chlorophenyl)methyl]thiourea IUPAC Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-[(4-chlorophenyl)methyl]thiourea Traditional Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-(4-chlorobenzyl)thiourea Formula: C18H16BrClN4S MolecularWeight: 435.76844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=S)NCC2=CC=C(C=C2)Cl)CN3C=C(C=N3)Br

Isomeric SMILES

C1=CC(=CC(=C1)NC(=S)NCC2=CC=C(C=C2)Cl)CN3C=C(C=N3)Br

InChI

InChI=1S/C18H16BrClN4S/c19-15-10-22-24(12-15)11-14-2-1-3-17(8-14)23-18(25)21-9-13-4-6-16(20)7-5-13/h1-8,10,12H,9,11H2,(H2,21,23,25)