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

Systemtic Name: 3-[3-bromanyl-5-[4-bromanyl-6-(methylamino)pyridin-2-yl]sulfanyl-phenyl]-1-methyl-1-pent-3-ynyl-thiourea Openeye Name: 3-[3-bromo-5-[[4-bromo-6-(methylamino)-2-pyridyl]sulfanyl]phenyl]-1-methyl-1-pent-3-ynyl-thiourea CAS Name: 3-[3-bromo-5-[[4-bromo-6-(methylamino)-2-pyridinyl]thio]phenyl]-1-methyl-1-pent-3-ynylthiourea IUPAC Name: 3-[3-bromo-5-[4-bromo-6-(methylamino)pyridin-2-yl]sulfanylphenyl]-1-methyl-1-pent-3-ynylthiourea Traditional Name: 3-[3-bromo-5-[[4-bromo-6-(methylamino)-2-pyridyl]thio]phenyl]-1-methyl-1-pent-3-ynyl-thiourea Formula: C19H20Br2N4S2 MolecularWeight: 528.3269

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCN(C)C(=S)NC1=CC(=CC(=C1)Br)SC2=CC(=CC(=N2)NC)Br

Isomeric SMILES

CC#CCCN(C)C(=S)NC1=CC(=CC(=C1)Br)SC2=CC(=CC(=N2)NC)Br

InChI

InChI=1S/C19H20Br2N4S2/c1-4-5-6-7-25(3)19(26)23-15-8-13(20)9-16(12-15)27-18-11-14(21)10-17(22-2)24-18/h8-12H,6-7H2,1-3H3,(H,22,24)(H,23,26)