3-[3-bromanyl-5-[2-bromanyl-6-(methylamino)pyridin-4-yl]sulfanyl-phenyl]-1-butyl-1-methyl-thiourea

Systemtic Name: 3-[3-bromanyl-5-[2-bromanyl-6-(methylamino)pyridin-4-yl]sulfanyl-phenyl]-1-butyl-1-methyl-thiourea Openeye Name: 3-[3-bromo-5-[[2-bromo-6-(methylamino)-4-pyridyl]sulfanyl]phenyl]-1-butyl-1-methyl-thiourea CAS Name: 3-[3-bromo-5-[[2-bromo-6-(methylamino)-4-pyridinyl]thio]phenyl]-1-butyl-1-methylthiourea IUPAC Name: 3-[3-bromo-5-[2-bromo-6-(methylamino)pyridin-4-yl]sulfanylphenyl]-1-butyl-1-methylthiourea Traditional Name: 3-[3-bromo-5-[[2-bromo-6-(methylamino)-4-pyridyl]thio]phenyl]-1-butyl-1-methyl-thiourea Formula: C18H22Br2N4S2 MolecularWeight: 518.33208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=S)NC1=CC(=CC(=C1)Br)SC2=CC(=NC(=C2)Br)NC

Isomeric SMILES

CCCCN(C)C(=S)NC1=CC(=CC(=C1)Br)SC2=CC(=NC(=C2)Br)NC

InChI

InChI=1S/C18H22Br2N4S2/c1-4-5-6-24(3)18(25)22-13-7-12(19)8-14(9-13)26-15-10-16(20)23-17(11-15)21-2/h7-11H,4-6H2,1-3H3,(H,21,23)(H,22,25)