1-methyl-1-pent-4-yn-2-yl-3-(2-pyridin-2-ylsulfanylphenyl)urea

Systemtic Name: 1-methyl-1-pent-4-yn-2-yl-3-(2-pyridin-2-ylsulfanylphenyl)urea Openeye Name: 1-methyl-1-(1-methylbut-3-ynyl)-3-[2-(2-pyridylsulfanyl)phenyl]urea CAS Name: 1-methyl-1-pent-4-yn-2-yl-3-[2-(2-pyridinylthio)phenyl]urea IUPAC Name: 1-methyl-1-pent-4-yn-2-yl-3-(2-pyridin-2-ylsulfanylphenyl)urea Traditional Name: 1-methyl-1-(1-methylbut-3-ynyl)-3-[2-(2-pyridylthio)phenyl]urea Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#C)N(C)C(=O)NC1=CC=CC=C1SC2=CC=CC=N2

Isomeric SMILES

CC(CC#C)N(C)C(=O)NC1=CC=CC=C1SC2=CC=CC=N2

InChI

InChI=1S/C18H19N3OS/c1-4-9-14(2)21(3)18(22)20-15-10-5-6-11-16(15)23-17-12-7-8-13-19-17/h1,5-8,10-14H,9H2,2-3H3,(H,20,22)