3-[3-chloranyl-4-(6-iodanylpyridin-2-yl)sulfanyl-phenyl]-1-methyl-1-pent-4-en-2-yl-urea

Systemtic Name: 3-[3-chloranyl-4-(6-iodanylpyridin-2-yl)sulfanyl-phenyl]-1-methyl-1-pent-4-en-2-yl-urea Openeye Name: 3-[3-chloro-4-[(6-iodo-2-pyridyl)sulfanyl]phenyl]-1-methyl-1-(1-methylbut-3-enyl)urea CAS Name: 3-[3-chloro-4-[(6-iodo-2-pyridinyl)thio]phenyl]-1-methyl-1-pent-4-en-2-ylurea IUPAC Name: 3-[3-chloro-4-(6-iodopyridin-2-yl)sulfanylphenyl]-1-methyl-1-pent-4-en-2-ylurea Traditional Name: 3-[3-chloro-4-[(6-iodo-2-pyridyl)thio]phenyl]-1-methyl-1-(1-methylbut-3-enyl)urea Formula: C18H19ClIN3OS MolecularWeight: 487.78543

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=C)N(C)C(=O)NC1=CC(=C(C=C1)SC2=NC(=CC=C2)I)Cl

Isomeric SMILES

CC(CC=C)N(C)C(=O)NC1=CC(=C(C=C1)SC2=NC(=CC=C2)I)Cl

InChI

InChI=1S/C18H19ClIN3OS/c1-4-6-12(2)23(3)18(24)21-13-9-10-15(14(19)11-13)25-17-8-5-7-16(20)22-17/h4-5,7-12H,1,6H2,2-3H3,(H,21,24)