(4-bromanyl-5-cyclopropyl-1,2-oxazol-3-yl)-[2-(propan-2-ylsulfanylmethyl)phenyl]methanone

Systemtic Name: (4-bromanyl-5-cyclopropyl-1,2-oxazol-3-yl)-[2-(propan-2-ylsulfanylmethyl)phenyl]methanone Openeye Name: (4-bromo-5-cyclopropyl-isoxazol-3-yl)-[2-(isopropylsulfanylmethyl)phenyl]methanone CAS Name: (4-bromo-5-cyclopropyl-3-isoxazolyl)-[2-[(propan-2-ylthio)methyl]phenyl]methanone IUPAC Name: (4-bromo-5-cyclopropyl-1,2-oxazol-3-yl)-[2-(propan-2-ylsulfanylmethyl)phenyl]methanone Traditional Name: (4-bromo-5-cyclopropyl-isoxazol-3-yl)-[2-[(isopropylthio)methyl]phenyl]methanone Formula: C17H18BrNO2S MolecularWeight: 380.29932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC1=CC=CC=C1C(=O)C2=NOC(=C2Br)C3CC3

Isomeric SMILES

CC(C)SCC1=CC=CC=C1C(=O)C2=NOC(=C2Br)C3CC3

InChI

InChI=1S/C17H18BrNO2S/c1-10(2)22-9-12-5-3-4-6-13(12)16(20)15-14(18)17(21-19-15)11-7-8-11/h3-6,10-11H,7-9H2,1-2H3