1-(4-bromanyl-2-chloranyl-phenyl)-3-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-(4-pyridylmethyl)thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-(4-pyridylmethyl)thiourea Formula: C13H11BrClN3S MolecularWeight: 356.66854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)NC(=S)NCC2=CC=NC=C2

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)NC(=S)NCC2=CC=NC=C2

InChI

InChI=1S/C13H11BrClN3S/c14-10-1-2-12(11(15)7-10)18-13(19)17-8-9-3-5-16-6-4-9/h1-7H,8H2,(H2,17,18,19)