1-[4-bromanyl-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-(3-chloranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-[4-bromanyl-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-(3-chloranyl-4-methyl-phenyl)thiourea Openeye Name: 1-[4-bromo-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-(3-chloro-4-methyl-phenyl)thiourea CAS Name: 1-[4-bromo-1-[(4-chlorophenyl)methyl]-3-pyrazolyl]-3-(3-chloro-4-methylphenyl)thiourea IUPAC Name: 1-[4-bromo-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-(3-chloro-4-methylphenyl)thiourea Traditional Name: 1-[4-bromo-1-(4-chlorobenzyl)pyrazol-3-yl]-3-(3-chloro-4-methyl-phenyl)thiourea Formula: C18H15BrCl2N4S MolecularWeight: 470.2135

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=NN(C=C2Br)CC3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=NN(C=C2Br)CC3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H15BrCl2N4S/c1-11-2-7-14(8-16(11)21)22-18(26)23-17-15(19)10-25(24-17)9-12-3-5-13(20)6-4-12/h2-8,10H,9H2,1H3,(H2,22,23,24,26)