5-(4-bromophenyl)sulfanyl-2-tert-butyl-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(4-bromophenyl)sulfanyl-2-tert-butyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-(4-bromophenyl)sulfanyl-2-tert-butyl-oxazole-4-carbonitrile CAS Name: 5-[(4-bromophenyl)thio]-2-tert-butyl-4-oxazolecarbonitrile IUPAC Name: 5-(4-bromophenyl)sulfanyl-2-tert-butyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-[(4-bromophenyl)thio]-2-tert-butyl-oxazole-4-carbonitrile Formula: C14H13BrN2OS MolecularWeight: 337.23482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=C(O1)SC2=CC=C(C=C2)Br)C#N

Isomeric SMILES

CC(C)(C)C1=NC(=C(O1)SC2=CC=C(C=C2)Br)C#N

InChI

InChI=1S/C14H13BrN2OS/c1-14(2,3)13-17-11(8-16)12(18-13)19-10-6-4-9(15)5-7-10/h4-7H,1-3H3